CAS RN: 103737-05-9
CAS Name: 2,3,4,5-tetrahydroxy-6-[[3,4,5-trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxymethyl]-2-oxanyl]oxy]hexanal
OPENEYE Name: 2,3,4,5-tetrahydroxy-6-[3,4,5-trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxymethyl]tetrahydropyran-2-yl]oxy-hexanal
IUPAC Name: 2,3,4,5-tetrahydroxy-6-[3,4,5-trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxyhexanal
SYSTEMATIC NAME: 6-[6-[[6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxymethyl]-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-2,3,4,5-tetrakis(oxidanyl)hexanal
MOLECULAR FORMULA: C18H32O16
MOLECULAR WEIGHT: 504.43708
SMILES: C(C1C(C(C(C(O1)OCC2C(C(C(C(O2)OCC(C(C(C(C=O)O)O)O)O)O)O)O)O)O)O)O
Structure:
CAS RN: 11104-36-2
CAS Name: 2,3,4,5-tetrahydroxy-6-[[3,4,5-trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxymethyl]-2-oxanyl]oxy]hexanal
OPENEYE Name: 2,3,4,5-tetrahydroxy-6-[3,4,5-trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxymethyl]tetrahydropyran-2-yl]oxy-hexanal
IUPAC Name: 2,3,4,5-tetrahydroxy-6-[3,4,5-trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxyhexanal
SYSTEMATIC NAME: 6-[6-[[6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxymethyl]-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-2,3,4,5-tetrakis(oxidanyl)hexanal
MOLECULAR FORMULA: C18H32O16
MOLECULAR WEIGHT: 504.43708
SMILES: C(C1C(C(C(C(O1)OCC2C(C(C(C(O2)OCC(C(C(C(C=O)O)O)O)O)O)O)O)O)O)O)O
Structure:
CAS RN: 11121-03-2
CAS Name: 2,3,4,5-tetrahydroxy-6-[[3,4,5-trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxymethyl]-2-oxanyl]oxy]hexanal
OPENEYE Name: 2,3,4,5-tetrahydroxy-6-[3,4,5-trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxymethyl]tetrahydropyran-2-yl]oxy-hexanal
IUPAC Name: 2,3,4,5-tetrahydroxy-6-[3,4,5-trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxyhexanal
SYSTEMATIC NAME: 6-[6-[[6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxymethyl]-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-2,3,4,5-tetrakis(oxidanyl)hexanal
MOLECULAR FORMULA: C18H32O16
MOLECULAR WEIGHT: 504.43708
SMILES: C(C1C(C(C(C(O1)OCC2C(C(C(C(O2)OCC(C(C(C(C=O)O)O)O)O)O)O)O)O)O)O)O
Structure:
CAS RN: 12626-85-6
CAS Name: 2,3,4,5-tetrahydroxy-6-[[3,4,5-trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxymethyl]-2-oxanyl]oxy]hexanal
OPENEYE Name: 2,3,4,5-tetrahydroxy-6-[3,4,5-trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxymethyl]tetrahydropyran-2-yl]oxy-hexanal
IUPAC Name: 2,3,4,5-tetrahydroxy-6-[3,4,5-trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxyhexanal
SYSTEMATIC NAME: 6-[6-[[6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxymethyl]-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-2,3,4,5-tetrakis(oxidanyl)hexanal
MOLECULAR FORMULA: C18H32O16
MOLECULAR WEIGHT: 504.43708
SMILES: C(C1C(C(C(C(O1)OCC2C(C(C(C(O2)OCC(C(C(C(C=O)O)O)O)O)O)O)O)O)O)O)O
Structure:
CAS RN: 128635-03-0
CAS Name: 2,3,4,5-tetrahydroxy-6-[[3,4,5-trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxymethyl]-2-oxanyl]oxy]hexanal
OPENEYE Name: 2,3,4,5-tetrahydroxy-6-[3,4,5-trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxymethyl]tetrahydropyran-2-yl]oxy-hexanal
IUPAC Name: 2,3,4,5-tetrahydroxy-6-[3,4,5-trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxyhexanal
SYSTEMATIC NAME: 6-[6-[[6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxymethyl]-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-2,3,4,5-tetrakis(oxidanyl)hexanal
MOLECULAR FORMULA: C18H32O16
MOLECULAR WEIGHT: 504.43708
SMILES: C(C1C(C(C(C(O1)OCC2C(C(C(C(O2)OCC(C(C(C(C=O)O)O)O)O)O)O)O)O)O)O)O
Structure:
CAS RN: 37224-17-2
CAS Name: 2,3,4,5-tetrahydroxy-6-[[3,4,5-trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxymethyl]-2-oxanyl]oxy]hexanal
OPENEYE Name: 2,3,4,5-tetrahydroxy-6-[3,4,5-trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxymethyl]tetrahydropyran-2-yl]oxy-hexanal
IUPAC Name: 2,3,4,5-tetrahydroxy-6-[3,4,5-trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxyhexanal
SYSTEMATIC NAME: 6-[6-[[6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxymethyl]-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-2,3,4,5-tetrakis(oxidanyl)hexanal
MOLECULAR FORMULA: C18H32O16
MOLECULAR WEIGHT: 504.43708
SMILES: C(C1C(C(C(C(O1)OCC2C(C(C(C(O2)OCC(C(C(C(C=O)O)O)O)O)O)O)O)O)O)O)O
Structure:
CAS RN: 60454-72-0
CAS Name: 2,3,4,5-tetrahydroxy-6-[[3,4,5-trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxymethyl]-2-oxanyl]oxy]hexanal
OPENEYE Name: 2,3,4,5-tetrahydroxy-6-[3,4,5-trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxymethyl]tetrahydropyran-2-yl]oxy-hexanal
IUPAC Name: 2,3,4,5-tetrahydroxy-6-[3,4,5-trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxyhexanal
SYSTEMATIC NAME: 6-[6-[[6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxymethyl]-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-2,3,4,5-tetrakis(oxidanyl)hexanal
MOLECULAR FORMULA: C18H32O16
MOLECULAR WEIGHT: 504.43708
SMILES: C(C1C(C(C(C(O1)OCC2C(C(C(C(O2)OCC(C(C(C(C=O)O)O)O)O)O)O)O)O)O)O)O
Structure:
CAS RN: 86280-85-5
CAS Name: 2,3,4,5-tetrahydroxy-6-[[3,4,5-trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxymethyl]-2-oxanyl]oxy]hexanal
OPENEYE Name: 2,3,4,5-tetrahydroxy-6-[3,4,5-trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxymethyl]tetrahydropyran-2-yl]oxy-hexanal
IUPAC Name: 2,3,4,5-tetrahydroxy-6-[3,4,5-trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxyhexanal
SYSTEMATIC NAME: 6-[6-[[6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxymethyl]-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-2,3,4,5-tetrakis(oxidanyl)hexanal
MOLECULAR FORMULA: C18H32O16
MOLECULAR WEIGHT: 504.43708
SMILES: C(C1C(C(C(C(O1)OCC2C(C(C(C(O2)OCC(C(C(C(C=O)O)O)O)O)O)O)O)O)O)O)O
Structure:
CAS RN: 9013-80-3
CAS Name: 2,3,4,5-tetrahydroxy-6-[[3,4,5-trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxymethyl]-2-oxanyl]oxy]hexanal
OPENEYE Name: 2,3,4,5-tetrahydroxy-6-[3,4,5-trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxymethyl]tetrahydropyran-2-yl]oxy-hexanal
IUPAC Name: 2,3,4,5-tetrahydroxy-6-[3,4,5-trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxyhexanal
SYSTEMATIC NAME: 6-[6-[[6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxymethyl]-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-2,3,4,5-tetrakis(oxidanyl)hexanal
MOLECULAR FORMULA: C18H32O16
MOLECULAR WEIGHT: 504.43708
SMILES: C(C1C(C(C(C(O1)OCC2C(C(C(C(O2)OCC(C(C(C(C=O)O)O)O)O)O)O)O)O)O)O)O
Structure:
CAS RN: 9044-66-0
CAS Name: 2,3,4,5-tetrahydroxy-6-[[3,4,5-trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxymethyl]-2-oxanyl]oxy]hexanal
OPENEYE Name: 2,3,4,5-tetrahydroxy-6-[3,4,5-trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxymethyl]tetrahydropyran-2-yl]oxy-hexanal
IUPAC Name: 2,3,4,5-tetrahydroxy-6-[3,4,5-trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxyhexanal
SYSTEMATIC NAME: 6-[6-[[6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxymethyl]-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-2,3,4,5-tetrakis(oxidanyl)hexanal
MOLECULAR FORMULA: C18H32O16
MOLECULAR WEIGHT: 504.43708
SMILES: C(C1C(C(C(C(O1)OCC2C(C(C(C(O2)OCC(C(C(C(C=O)O)O)O)O)O)O)O)O)O)O)O
Structure:
CAS RN: 911319-01-2
CAS Name: 2,3,4,5-tetrahydroxy-6-[[3,4,5-trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxymethyl]-2-oxanyl]oxy]hexanal
OPENEYE Name: 2,3,4,5-tetrahydroxy-6-[3,4,5-trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxymethyl]tetrahydropyran-2-yl]oxy-hexanal
IUPAC Name: 2,3,4,5-tetrahydroxy-6-[3,4,5-trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxyhexanal
SYSTEMATIC NAME: 6-[6-[[6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxymethyl]-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-2,3,4,5-tetrakis(oxidanyl)hexanal
MOLECULAR FORMULA: C18H32O16
MOLECULAR WEIGHT: 504.43708
SMILES: C(C1C(C(C(C(O1)OCC2C(C(C(C(O2)OCC(C(C(C(C=O)O)O)O)O)O)O)O)O)O)O)O
Structure:
CAS RN: 21928-51-8
CAS Name: 5-bromo-1,2,3-trichlorobenzene
OPENEYE Name: 5-bromo-1,2,3-trichloro-benzene
IUPAC Name: 5-bromo-1,2,3-trichlorobenzene
SYSTEMATIC NAME: 5-bromanyl-1,2,3-tris(chloranyl)benzene
MOLECULAR FORMULA: C6H2BrCl3
MOLECULAR WEIGHT: 260.34308
SMILES: C1=C(C=C(C(=C1Cl)Cl)Cl)Br
Structure:
CAS RN: 19781-12-5
CAS Name: 3,5-dimethyl-4-octanol
OPENEYE Name: 3,5-dimethyloctan-4-ol
IUPAC Name: 3,5-dimethyloctan-4-ol
SYSTEMATIC NAME: 3,5-dimethyloctan-4-ol
MOLECULAR FORMULA: C10H22O
MOLECULAR WEIGHT: 158.28108
SMILES: CCCC(C)C(C(C)CC)O
Structure:
CAS RN: 30467-02-8
CAS Name: 8-methyl-3,7-dihydropurin-6-one
OPENEYE Name: 8-methyl-3,7-dihydropurin-6-one
IUPAC Name: 8-methyl-3,7-dihydropurin-6-one
SYSTEMATIC NAME: 8-methyl-3,7-dihydropurin-6-one
MOLECULAR FORMULA: C6H6N4O
MOLECULAR WEIGHT: 150.13804
SMILES: CC1=NC2=C(N1)C(=O)N=CN2
Structure:
CAS RN: 93501-51-0
CAS Name: 5-oxo-N-[3-(trifluoromethyl)phenyl]-2,3-dihydrothiazolo[3,2-a]pyrimidine-6-carboxamide
OPENEYE Name: 5-oxo-N-[3-(trifluoromethyl)phenyl]-2,3-dihydrothiazolo[3,2-a]pyrimidine-6-carboxamide
IUPAC Name: 5-oxo-N-[3-(trifluoromethyl)phenyl]-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
SYSTEMATIC NAME: 5-oxidanylidene-N-[3-(trifluoromethyl)phenyl]-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
MOLECULAR FORMULA: C14H10F3N3O2S
MOLECULAR WEIGHT: 341.30831
SMILES: C1CSC2=NC=C(C(=O)N21)C(=O)NC3=CC=CC(=C3)C(F)(F)F
Structure:
CAS RN: 103-04-8
CAS Name: 2-(phenylthio)acetate
OPENEYE Name: 2-phenylsulfanylacetate
IUPAC Name: 2-phenylsulfanylacetate
SYSTEMATIC NAME: 2-phenylsulfanylethanoate
MOLECULAR FORMULA: C8H7O2S-
MOLECULAR WEIGHT: 167.20498
SMILES: C1=CC=C(C=C1)SCC(=O)[O-]
Structure:
CAS RN: 79695-13-9
CAS Name: 6-[[2-amino-3-(carboxymethylamino)-3-oxopropyl]thio]-5-hydroxyeicosa-7,9,11,14,17-pentaenoic acid
OPENEYE Name: 6-[2-amino-3-(carboxymethylamino)-3-oxo-propyl]sulfanyl-5-hydroxy-icosa-7,9,11,14,17-pentaenoic acid
IUPAC Name: 6-[2-amino-3-(carboxymethylamino)-3-oxopropyl]sulfanyl-5-hydroxyicosa-7,9,11,14,17-pentaenoic acid
SYSTEMATIC NAME: 6-[2-azanyl-3-(2-hydroxy-2-oxoethylamino)-3-oxidanylidene-propyl]sulfanyl-5-oxidanyl-icosa-7,9,11,14,17-pentaenoic acid
MOLECULAR FORMULA: C25H38N2O6S
MOLECULAR WEIGHT: 494.64402
SMILES: CCC=CCC=CCC=CC=CC=CC(C(CCCC(=O)O)O)SCC(C(=O)NCC(=O)O)N
Structure:
CAS RN: 80724-20-5
CAS Name: 2-[3-(dimethylamino)-6-dimethyliminio-9-xanthenyl]-4-isothiocyanatobenzoate
OPENEYE Name: 2-[3-(dimethylamino)-6-dimethyliminio-xanthen-9-yl]-4-isothiocyanato-benzoate
IUPAC Name: 2-[3-(dimethylamino)-6-dimethylazaniumylidenexanthen-9-yl]-4-isothiocyanatobenzoate
SYSTEMATIC NAME: 2-[3-(dimethylamino)-6-dimethylazaniumylidene-xanthen-9-yl]-4-isothiocyanato-benzoate
MOLECULAR FORMULA: C25H21N3O3S
MOLECULAR WEIGHT: 443.51754
SMILES: CN(C)C1=CC2=C(C=C1)C(=C3C=CC(=[N+](C)C)C=C3O2)C4=C(C=CC(=C4)N=C=S)C(=O)[O-]
Structure:
CAS RN: 37763-23-8
CAS Name: 2-amino-2-(4-hydroxyphenyl)acetic acid methyl ester
OPENEYE Name: methyl 2-amino-2-(4-hydroxyphenyl)acetate
IUPAC Name: methyl 2-amino-2-(4-hydroxyphenyl)acetate
SYSTEMATIC NAME: methyl 2-azanyl-2-(4-hydroxyphenyl)ethanoate
MOLECULAR FORMULA: C9H11NO3
MOLECULAR WEIGHT: 181.18854
SMILES: COC(=O)C(C1=CC=C(C=C1)O)N
Structure:
CAS RN: 2946-36-3
CAS Name: acetic acid [3,4-diacetyloxy-5-(2-amino-6-sulfanylidene-3H-purin-9-yl)-2-oxolanyl]methyl ester
OPENEYE Name: [3,4-diacetoxy-5-(2-amino-6-thioxo-3H-purin-9-yl)tetrahydrofuran-2-yl]methyl acetate
IUPAC Name: [3,4-diacetyloxy-5-(2-amino-6-sulfanylidene-3H-purin-9-yl)oxolan-2-yl]methyl acetate
SYSTEMATIC NAME: [3,4-diacetyloxy-5-(2-azanyl-6-sulfanylidene-3H-purin-9-yl)oxolan-2-yl]methyl ethanoate
MOLECULAR FORMULA: C16H19N5O7S
MOLECULAR WEIGHT: 425.41636
SMILES: CC(=O)OCC1C(C(C(O1)N2C=NC3=C2NC(=NC3=S)N)OC(=O)C)OC(=O)C
Structure:
CAS RN: 34793-14-1
CAS Name: acetic acid [3,4-diacetyloxy-5-(2-amino-6-sulfanylidene-3H-purin-9-yl)-2-oxolanyl]methyl ester
OPENEYE Name: [3,4-diacetoxy-5-(2-amino-6-thioxo-3H-purin-9-yl)tetrahydrofuran-2-yl]methyl acetate
IUPAC Name: [3,4-diacetyloxy-5-(2-amino-6-sulfanylidene-3H-purin-9-yl)oxolan-2-yl]methyl acetate
SYSTEMATIC NAME: [3,4-diacetyloxy-5-(2-azanyl-6-sulfanylidene-3H-purin-9-yl)oxolan-2-yl]methyl ethanoate
MOLECULAR FORMULA: C16H19N5O7S
MOLECULAR WEIGHT: 425.41636
SMILES: CC(=O)OCC1C(C(C(O1)N2C=NC3=C2NC(=NC3=S)N)OC(=O)C)OC(=O)C
Structure:
CAS RN: 34793-15-2
CAS Name: acetic acid [3,4-diacetyloxy-5-(2-amino-6-sulfanylidene-3H-purin-9-yl)-2-oxolanyl]methyl ester
OPENEYE Name: [3,4-diacetoxy-5-(2-amino-6-thioxo-3H-purin-9-yl)tetrahydrofuran-2-yl]methyl acetate
IUPAC Name: [3,4-diacetyloxy-5-(2-amino-6-sulfanylidene-3H-purin-9-yl)oxolan-2-yl]methyl acetate
SYSTEMATIC NAME: [3,4-diacetyloxy-5-(2-azanyl-6-sulfanylidene-3H-purin-9-yl)oxolan-2-yl]methyl ethanoate
MOLECULAR FORMULA: C16H19N5O7S
MOLECULAR WEIGHT: 425.41636
SMILES: CC(=O)OCC1C(C(C(O1)N2C=NC3=C2NC(=NC3=S)N)OC(=O)C)OC(=O)C
Structure:
CAS RN: 34793-20-9
CAS Name: acetic acid [3,4-diacetyloxy-5-(2-amino-6-sulfanylidene-3H-purin-9-yl)-2-oxolanyl]methyl ester
OPENEYE Name: [3,4-diacetoxy-5-(2-amino-6-thioxo-3H-purin-9-yl)tetrahydrofuran-2-yl]methyl acetate
IUPAC Name: [3,4-diacetyloxy-5-(2-amino-6-sulfanylidene-3H-purin-9-yl)oxolan-2-yl]methyl acetate
SYSTEMATIC NAME: [3,4-diacetyloxy-5-(2-azanyl-6-sulfanylidene-3H-purin-9-yl)oxolan-2-yl]methyl ethanoate
MOLECULAR FORMULA: C16H19N5O7S
MOLECULAR WEIGHT: 425.41636
SMILES: CC(=O)OCC1C(C(C(O1)N2C=NC3=C2NC(=NC3=S)N)OC(=O)C)OC(=O)C
Structure:
CAS RN: 1013-25-8
CAS Name: 1-(2,5-dimethylphenyl)piperazin-4-ium
OPENEYE Name: 1-(2,5-dimethylphenyl)piperazin-4-ium
IUPAC Name: 1-(2,5-dimethylphenyl)piperazin-4-ium
SYSTEMATIC NAME: 1-(2,5-dimethylphenyl)piperazin-4-ium
MOLECULAR FORMULA: C12H19N2+
MOLECULAR WEIGHT: 191.29266
SMILES: CC1=CC(=C(C=C1)C)N2CC[NH2+]CC2
Structure:
CAS RN: 99117-21-2
CAS Name: 2-(phenylmethyl)-1,2,3,4-tetrahydrobenzo[b][1,6]naphthyridin-2-ium-10-carboxylate
OPENEYE Name: 2-benzyl-1,2,3,4-tetrahydrobenzo[b][1,6]naphthyridin-2-ium-10-carboxylate
IUPAC Name: 2-benzyl-1,2,3,4-tetrahydrobenzo[b][1,6]naphthyridin-2-ium-10-carboxylate
SYSTEMATIC NAME: 2-(phenylmethyl)-1,2,3,4-tetrahydrobenzo[b][1,6]naphthyridin-2-ium-10-carboxylate
MOLECULAR FORMULA: C20H18N2O2
MOLECULAR WEIGHT: 318.36912
SMILES: C1C[NH+](CC2=C(C3=CC=CC=C3N=C21)C(=O)[O-])CC4=CC=CC=C4
Structure:
CAS RN: 65894-83-9
CAS Name: 4,5-dimethyl-2-(2-methylpropyl)-2,5-dihydrothiazole
OPENEYE Name: 2-isobutyl-4,5-dimethyl-2,5-dihydrothiazole
IUPAC Name: 4,5-dimethyl-2-(2-methylpropyl)-2,5-dihydro-1,3-thiazole
SYSTEMATIC NAME: 4,5-dimethyl-2-(2-methylpropyl)-2,5-dihydro-1,3-thiazole
MOLECULAR FORMULA: C9H17NS
MOLECULAR WEIGHT: 171.30298
SMILES: CC1C(=NC(S1)CC(C)C)C
Structure:
CAS RN: 119778-05-1
CAS Name: potassium 9,10-dioxo-1-anthracenesulfonate
OPENEYE Name: potassium 9,10-dioxoanthracene-1-sulfonate
IUPAC Name: potassium 9,10-dioxoanthracene-1-sulfonate
SYSTEMATIC NAME: potassium 9,10-bis(oxidanylidene)anthracene-1-sulfonate
MOLECULAR FORMULA: C14H7KO5S
MOLECULAR WEIGHT: 326.36568
SMILES: C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)S(=O)(=O)[O-].[K+]
Structure:
CAS RN: 30845-78-4
CAS Name: potassium 9,10-dioxo-1-anthracenesulfonate
OPENEYE Name: potassium 9,10-dioxoanthracene-1-sulfonate
IUPAC Name: potassium 9,10-dioxoanthracene-1-sulfonate
SYSTEMATIC NAME: potassium 9,10-bis(oxidanylidene)anthracene-1-sulfonate
MOLECULAR FORMULA: C14H7KO5S
MOLECULAR WEIGHT: 326.36568
SMILES: C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)S(=O)(=O)[O-].[K+]
Structure:
CAS RN: 863-57-0
CAS Name: sodium 2-[[1-oxo-4-(3,7,12-trihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentyl]amino]acetate
OPENEYE Name: sodium 2-[4-(3,7,12-trihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoylamino]acetate
IUPAC Name: sodium 2-[4-(3,7,12-trihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoylamino]acetate
SYSTEMATIC NAME: sodium 2-[4-[10,13-dimethyl-3,7,12-tris(oxidanyl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoylamino]ethanoate
MOLECULAR FORMULA: C26H42NNaO6
MOLECULAR WEIGHT: 487.60455
SMILES: CC(CCC(=O)NCC(=O)[O-])C1CCC2C1(C(CC3C2C(CC4C3(CCC(C4)O)C)O)O)C.[Na+]
Structure:
CAS RN: 108321-10-4
CAS Name: sodium 2,3,4,5-tetrabromo-6-[(3,5-dibromo-4-hydroxyphenyl)-(3,5-dibromo-4-oxo-1-cyclohexa-2,5-dienylidene)methyl]benzenesulfonate
OPENEYE Name: sodium 2,3,4,5-tetrabromo-6-[(3,5-dibromo-4-hydroxy-phenyl)-(3,5-dibromo-4-oxo-cyclohexa-2,5-dien-1-ylidene)methyl]benzenesulfonate
IUPAC Name: sodium 2,3,4,5-tetrabromo-6-[(3,5-dibromo-4-hydroxyphenyl)-(3,5-dibromo-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]benzenesulfonate
SYSTEMATIC NAME: sodium 2-[[3,5-bis(bromanyl)-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene]-[3,5-bis(bromanyl)-4-oxidanyl-phenyl]methyl]-3,4,5,6-tetrakis(bromanyl)benzenesulfonate
MOLECULAR FORMULA: C19H5Br8NaO5S
MOLECULAR WEIGHT: 1007.52677
SMILES: C1=C(C=C(C(=C1Br)O)Br)C(=C2C=C(C(=O)C(=C2)Br)Br)C3=C(C(=C(C(=C3Br)Br)Br)Br)S(=O)(=O)[O-].[Na+]
Structure:
CAS RN: 211735-76-1
CAS Name: 2,1,3-benzoxadiazol-5-yl(1-piperidinyl)methanone
OPENEYE Name: 2,1,3-benzoxadiazol-5-yl(1-piperidyl)methanone
IUPAC Name: 2,1,3-benzoxadiazol-5-yl(piperidin-1-yl)methanone
SYSTEMATIC NAME: 2,1,3-benzoxadiazol-5-yl(piperidin-1-yl)methanone
MOLECULAR FORMULA: C12H13N3O2
MOLECULAR WEIGHT: 231.25052
SMILES: C1CCN(CC1)C(=O)C2=CC3=NON=C3C=C2
Structure:
CAS RN: 224047-75-0
CAS Name: 2,1,3-benzoxadiazol-5-yl(1-piperidinyl)methanone
OPENEYE Name: 2,1,3-benzoxadiazol-5-yl(1-piperidyl)methanone
IUPAC Name: 2,1,3-benzoxadiazol-5-yl(piperidin-1-yl)methanone
SYSTEMATIC NAME: 2,1,3-benzoxadiazol-5-yl(piperidin-1-yl)methanone
MOLECULAR FORMULA: C12H13N3O2
MOLECULAR WEIGHT: 231.25052
SMILES: C1CCN(CC1)C(=O)C2=CC3=NON=C3C=C2
Structure:
CAS RN: 13901-38-7
CAS Name: 3-(2-ethyl-1-piperidinyl)-1-propanamine
OPENEYE Name: 3-(2-ethyl-1-piperidyl)propan-1-amine
IUPAC Name: 3-(2-ethylpiperidin-1-yl)propan-1-amine
SYSTEMATIC NAME: 3-(2-ethylpiperidin-1-yl)propan-1-amine
MOLECULAR FORMULA: C10H22N2
MOLECULAR WEIGHT: 170.29508
SMILES: CCC1CCCCN1CCCN
Structure:
CAS RN: 4593-20-8
CAS Name: 2-chloro-1-(4-methyl-1-piperidinyl)ethanone
OPENEYE Name: 2-chloro-1-(4-methyl-1-piperidyl)ethanone
IUPAC Name: 2-chloro-1-(4-methylpiperidin-1-yl)ethanone
SYSTEMATIC NAME: 2-chloranyl-1-(4-methylpiperidin-1-yl)ethanone
MOLECULAR FORMULA: C8H14ClNO
MOLECULAR WEIGHT: 175.65586
SMILES: CC1CCN(CC1)C(=O)CCl
Structure:
CAS RN: 100900-07-0
CAS Name: sodium 5-(2-aminoethylamino)-1-naphthalenesulfonate
OPENEYE Name: sodium 5-(2-aminoethylamino)naphthalene-1-sulfonate
IUPAC Name: sodium 5-(2-aminoethylamino)naphthalene-1-sulfonate
SYSTEMATIC NAME: sodium 5-(2-azanylethylamino)naphthalene-1-sulfonate
MOLECULAR FORMULA: C12H13N2NaO3S
MOLECULAR WEIGHT: 288.29799
SMILES: C1=CC2=C(C=CC=C2S(=O)(=O)[O-])C(=C1)NCCN.[Na+]
Structure:
CAS RN: 332-51-4
CAS Name: 2-[(4-fluorophenyl)thio]acetate
OPENEYE Name: 2-(4-fluorophenyl)sulfanylacetate
IUPAC Name: 2-(4-fluorophenyl)sulfanylacetate
SYSTEMATIC NAME: 2-(4-fluorophenyl)sulfanylethanoate
MOLECULAR FORMULA: C8H6FO2S-
MOLECULAR WEIGHT: 185.195443
SMILES: C1=CC(=CC=C1F)SCC(=O)[O-]
Structure:
No comments:
Post a Comment