CAS RN: 31506-87-3
CAS Name: 2,4-dinitrobenzenediazonium sulfate
OPENEYE Name: 2,4-dinitrobenzenediazonium sulfate
IUPAC Name: 2,4-dinitrobenzenediazonium sulfate
SYSTEMATIC NAME: 2,4-dinitrobenzenediazonium sulfate
MOLECULAR FORMULA: C12H6N8O12S
MOLECULAR WEIGHT: 486.28744
SMILES: C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])[N+]#N.C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])[N+]#N.[O-]S(=O)(=O)[O-]
Structure:
CAS RN: 363-27-9
CAS Name: acetic acid 2-[N-(2-acetyloxyethyl)-3-benzamido-4-(2-chloro-4-nitrophenyl)azoanilino]ethyl ester
OPENEYE Name: 2-[N-(2-acetoxyethyl)-3-benzamido-4-(2-chloro-4-nitro-phenyl)azo-anilino]ethyl acetate
IUPAC Name: 2-[N-(2-acetyloxyethyl)-3-benzamido-4-[(2-chloro-4-nitrophenyl)diazenyl]anilino]ethyl acetate
SYSTEMATIC NAME: 2-[2-acetyloxyethyl-[3-benzamido-4-[(2-chloranyl-4-nitro-phenyl)diazenyl]phenyl]amino]ethyl ethanoate
MOLECULAR FORMULA: C27H26ClN5O7
MOLECULAR WEIGHT: 567.97764
SMILES: CC(=O)OCCN(CCOC(=O)C)C1=CC(=C(C=C1)N=NC2=C(C=C(C=C2)[N+](=O)[O-])Cl)NC(=O)C3=CC=CC=C3
Structure:
CAS RN: 31462-59-6
CAS Name: 4-pyrimidinecarboxylic acid
OPENEYE Name: pyrimidine-4-carboxylic acid
IUPAC Name: pyrimidine-4-carboxylic acid
SYSTEMATIC NAME: pyrimidine-4-carboxylic acid
MOLECULAR FORMULA: C5H4N2O2
MOLECULAR WEIGHT: 124.09746
SMILES: C1=CN=CN=C1C(=O)O
Structure:
CAS RN: 31426-72-9
CAS Name: 1-(chloromethyl)-2-phenoxybenzene
OPENEYE Name: 1-(chloromethyl)-2-phenoxy-benzene
IUPAC Name: 1-(chloromethyl)-2-phenoxybenzene
SYSTEMATIC NAME: 1-(chloromethyl)-2-phenoxy-benzene
MOLECULAR FORMULA: C13H11ClO
MOLECULAR WEIGHT: 218.67884
SMILES: C1=CC=C(C=C1)OC2=CC=CC=C2CCl
Structure:
CAS RN: 31352-39-3
CAS Name: disodium dodecanedioate
OPENEYE Name: disodium dodecanedioate
IUPAC Name: disodium dodecanedioate
SYSTEMATIC NAME: disodium dodecanedioate
MOLECULAR FORMULA: C12H20Na2O4
MOLECULAR WEIGHT: 274.26434
SMILES: C(CCCCCC(=O)[O-])CCCCC(=O)[O-].[Na+].[Na+]
Structure:
CAS RN: 94108-48-2
CAS Name: disodium dodecanedioate
OPENEYE Name: disodium dodecanedioate
IUPAC Name: disodium dodecanedioate
SYSTEMATIC NAME: disodium dodecanedioate
MOLECULAR FORMULA: C12H20Na2O4
MOLECULAR WEIGHT: 274.26434
SMILES: C(CCCCCC(=O)[O-])CCCCC(=O)[O-].[Na+].[Na+]
Structure:
CAS RN: 11069-23-1
CAS Name: copper N-methyl-N-oxidomethanethioamide
OPENEYE Name: copper N-methyl-N-oxido-thioformamide
IUPAC Name: copper N-methyl-N-oxidomethanethioamide
SYSTEMATIC NAME: copper N-methyl-N-oxidanidyl-methanethioamide
MOLECULAR FORMULA: C4H8CuN2O2S2
MOLECULAR WEIGHT: 243.79452
SMILES: CN(C=S)[O-].CN(C=S)[O-].[Cu+2]
Structure:
CAS RN: 31323-25-8
CAS Name: copper N-methyl-N-oxidomethanethioamide
OPENEYE Name: copper N-methyl-N-oxido-thioformamide
IUPAC Name: copper N-methyl-N-oxidomethanethioamide
SYSTEMATIC NAME: copper N-methyl-N-oxidanidyl-methanethioamide
MOLECULAR FORMULA: C4H8CuN2O2S2
MOLECULAR WEIGHT: 243.79452
SMILES: CN(C=S)[O-].CN(C=S)[O-].[Cu+2]
Structure:
CAS RN: 29656-65-3
CAS Name: 1-phenyl-2-(phenylmethyl)benzene
OPENEYE Name: 1-benzyl-2-phenyl-benzene
IUPAC Name: 1-benzyl-2-phenylbenzene
SYSTEMATIC NAME: 1-phenyl-2-(phenylmethyl)benzene
MOLECULAR FORMULA: C19H16
MOLECULAR WEIGHT: 244.33034
SMILES: C1=CC=C(C=C1)CC2=CC=CC=C2C3=CC=CC=C3
Structure:
CAS RN: 31307-59-2
CAS Name: 1-phenyl-2-(phenylmethyl)benzene
OPENEYE Name: 1-benzyl-2-phenyl-benzene
IUPAC Name: 1-benzyl-2-phenylbenzene
SYSTEMATIC NAME: 1-phenyl-2-(phenylmethyl)benzene
MOLECULAR FORMULA: C19H16
MOLECULAR WEIGHT: 244.33034
SMILES: C1=CC=C(C=C1)CC2=CC=CC=C2C3=CC=CC=C3
Structure:
CAS RN: 606-97-3
CAS Name: 1-phenyl-2-(phenylmethyl)benzene
OPENEYE Name: 1-benzyl-2-phenyl-benzene
IUPAC Name: 1-benzyl-2-phenylbenzene
SYSTEMATIC NAME: 1-phenyl-2-(phenylmethyl)benzene
MOLECULAR FORMULA: C19H16
MOLECULAR WEIGHT: 244.33034
SMILES: C1=CC=C(C=C1)CC2=CC=CC=C2C3=CC=CC=C3
Structure:
CAS RN: 36063-63-5
CAS Name: 4,7,13,18-tetraoxa-1,10-diazabicyclo[8.5.5]eicosane
OPENEYE Name: 4,7,13,18-tetraoxa-1,10-diazabicyclo[8.5.5]icosane
IUPAC Name: 4,7,13,18-tetraoxa-1,10-diazabicyclo[8.5.5]icosane
SYSTEMATIC NAME: 4,7,13,18-tetraoxa-1,10-diazabicyclo[8.5.5]icosane
MOLECULAR FORMULA: C14H28N2O4
MOLECULAR WEIGHT: 288.38312
SMILES: C1COCCN2CCOCCN1CCOCCOCC2
Structure:
CAS RN: 36027-81-3
CAS Name: 2,2,2-tribromoethylbenzene
OPENEYE Name: 2,2,2-tribromoethylbenzene
IUPAC Name: 2,2,2-tribromoethylbenzene
SYSTEMATIC NAME: 2,2,2-tris(bromanyl)ethylbenzene
MOLECULAR FORMULA: C8H7Br3
MOLECULAR WEIGHT: 342.85318
SMILES: C1=CC=C(C=C1)CC(Br)(Br)Br
Structure:
CAS RN: 109138-34-3
CAS Name: disodium N-hydroxy-N-sulfonatosulfamate
OPENEYE Name: disodium N-hydroxy-N-sulfonato-sulfamate
IUPAC Name: disodium N-hydroxy-N-sulfonatosulfamate
SYSTEMATIC NAME: disodium N-oxidanyl-N-sulfonato-sulfamate
MOLECULAR FORMULA: HNNa2O7S2
MOLECULAR WEIGHT: 237.11998
SMILES: N(O)(S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]
Structure:
CAS RN: 35970-06-0
CAS Name: [[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-2-oxolanyl]methoxy-hydroxyphosphoryl] [(2R,3S,4R,5R)-5-(5-carbamoyl-3,4-dihydro-2H-pyridin-1-yl)-3,4-dihydroxy-2-oxolanyl]methyl hydrogen phosphate
OPENEYE Name: [[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl] [(2R,3S,4R,5R)-5-(5-carbamoyl-3,4-dihydro-2H-pyridin-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl hydrogen phosphate
IUPAC Name: [[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2R,3S,4R,5R)-5-(5-carbamoyl-3,4-dihydro-2H-pyridin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl hydrogen phosphate
SYSTEMATIC NAME: [[(2R,3S,4R,5R)-5-(5-aminocarbonyl-3,4-dihydro-2H-pyridin-1-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methoxy-oxidanyl-phosphoryl] [(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl hydrogen phosphate
MOLECULAR FORMULA: C21H31N7O14P2
MOLECULAR WEIGHT: 667.456862
SMILES: C1CC(=CN(C1)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C4N=CN=C5N)O)O)O)O)C(=O)N
Structure:
CAS RN: 35929-79-4
CAS Name: (2R,3R,4S,5S,6R)-2-[[(2R,3S,4S,5R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)-2-oxolanyl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol; formaldehyde; 1,3,5-triazine-2,4,6-triamine
OPENEYE Name: (2R,3R,4S,5S,6R)-2-[(2R,3S,4S,5R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)tetrahydrofuran-2-yl]oxy-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol; formaldehyde; 1,3,5-triazine-2,4,6-triamine
IUPAC Name: (2R,3R,4S,5S,6R)-2-[(2R,3S,4S,5R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol; formaldehyde; 1,3,5-triazine-2,4,6-triamine
SYSTEMATIC NAME: (2R,3R,4S,5S,6R)-2-[(2R,3S,4S,5R)-2,5-bis(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol; methanal; 1,3,5-triazine-2,4,6-triamine
MOLECULAR FORMULA: C16H30N6O12
MOLECULAR WEIGHT: 498.4424
SMILES: C=O.C([C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)O[C@@]2([C@H]([C@@H]([C@H](O2)CO)O)O)CO)O)O)O)O.C1(=NC(=NC(=N1)N)N)N
Structure:
CAS RN: 26763-42-8
CAS Name: (2R,3R,4S,5S,6R)-2-[[(2R,3S,4S,5R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)-2-oxolanyl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol; formaldehyde; 1,3,5-triazine-2,4,6-triamine
OPENEYE Name: (2R,3R,4S,5S,6R)-2-[(2R,3S,4S,5R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)tetrahydrofuran-2-yl]oxy-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol; formaldehyde; 1,3,5-triazine-2,4,6-triamine
IUPAC Name: (2R,3R,4S,5S,6R)-2-[(2R,3S,4S,5R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol; formaldehyde; 1,3,5-triazine-2,4,6-triamine
SYSTEMATIC NAME: (2R,3R,4S,5S,6R)-2-[(2R,3S,4S,5R)-2,5-bis(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol; methanal; 1,3,5-triazine-2,4,6-triamine
MOLECULAR FORMULA: C16H30N6O12
MOLECULAR WEIGHT: 498.4424
SMILES: C=O.C([C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)O[C@@]2([C@H]([C@@H]([C@H](O2)CO)O)O)CO)O)O)O)O.C1(=NC(=NC(=N1)N)N)N
Structure:
CAS RN: 3592-44-7
CAS Name: dipotassium dioxido(dioxo)ruthenium
OPENEYE Name: dipotassium dioxido(dioxo)ruthenium
IUPAC Name: dipotassium dioxido(dioxo)ruthenium
SYSTEMATIC NAME: dipotassium bis(oxidanidyl)-bis(oxidanylidene)ruthenium
MOLECULAR FORMULA: K2O4Ru
MOLECULAR WEIGHT: 243.2642
SMILES: [O-][Ru](=O)(=O)[O-].[K+].[K+]
Structure:
CAS RN: 31078-36-1
CAS Name: N-[(4-hydroxy-3-methoxyphenyl)methyl]decanamide
OPENEYE Name: N-[(4-hydroxy-3-methoxy-phenyl)methyl]decanamide
IUPAC Name: N-[(4-hydroxy-3-methoxyphenyl)methyl]decanamide
SYSTEMATIC NAME: N-[(3-methoxy-4-oxidanyl-phenyl)methyl]decanamide
MOLECULAR FORMULA: C18H29NO3
MOLECULAR WEIGHT: 307.42776
SMILES: CCCCCCCCCC(=O)NCC1=CC(=C(C=C1)O)OC
Structure:
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