CAS RN: 4660-46-2
CAS Name: (6R,7R)-3-(hydroxymethyl)-8-oxo-7-[[1-oxo-2-(pyridin-4-ylthio)ethyl]amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
OPENEYE Name: (6R,7R)-3-(hydroxymethyl)-8-oxo-7-[[2-(4-pyridylsulfanyl)acetyl]amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
IUPAC Name: (6R,7R)-3-(hydroxymethyl)-8-oxo-7-[(2-pyridin-4-ylsulfanylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
SYSTEMATIC NAME: (6R,7R)-3-(hydroxymethyl)-8-oxidanylidene-7-(2-pyridin-4-ylsulfanylethanoylamino)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
MOLECULAR FORMULA: C15H15N3O5S2
MOLECULAR WEIGHT: 381.4267
SMILES: C1C(=C(N2[C@H](S1)[C@@H](C2=O)NC(=O)CSC3=CC=NC=C3)C(=O)O)CO
Structure:
CAS RN: 38076-80-1
CAS Name: 5-chloro-2-oxo-1H-pyridine-3-carboxylic acid
OPENEYE Name: 5-chloro-2-oxo-1H-pyridine-3-carboxylic acid
IUPAC Name: 5-chloro-2-oxo-1H-pyridine-3-carboxylic acid
SYSTEMATIC NAME: 5-chloranyl-2-oxidanylidene-1H-pyridine-3-carboxylic acid
MOLECULAR FORMULA: C6H4ClNO3
MOLECULAR WEIGHT: 173.55386
SMILES: C1=C(C(=O)NC=C1Cl)C(=O)O
Structure:
CAS RN: 844691-95-8
CAS Name: 4-(6,6-dimethyl-4-bicyclo[3.1.1]hept-3-enyl)butanal
OPENEYE Name: 4-(6,6-dimethyl-4-bicyclo[3.1.1]hept-3-enyl)butanal
IUPAC Name: 4-(6,6-dimethyl-4-bicyclo[3.1.1]hept-3-enyl)butanal
SYSTEMATIC NAME: 4-(6,6-dimethyl-4-bicyclo[3.1.1]hept-3-enyl)butanal
MOLECULAR FORMULA: C13H20O
MOLECULAR WEIGHT: 192.2973
SMILES: CC1(C2CC=C(C1C2)CCCC=O)C
Structure:
CAS RN: 18990-91-5
CAS Name: 3-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctylsulfonylamino)propyl-trimethylammonium chloride
OPENEYE Name: 3-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctylsulfonylamino)propyl-trimethyl-ammonium chloride
IUPAC Name: 3-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctylsulfonylamino)propyl-trimethylazanium chloride
SYSTEMATIC NAME: 3-[1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecakis(fluoranyl)octylsulfonylamino]propyl-trimethyl-azanium chloride
MOLECULAR FORMULA: C14H16ClF17N2O2S
MOLECULAR WEIGHT: 634.779894
SMILES: C[N+](C)(C)CCCNS(=O)(=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F.[Cl-]
Structure:
CAS RN: 38006-74-5
CAS Name: 3-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctylsulfonylamino)propyl-trimethylammonium chloride
OPENEYE Name: 3-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctylsulfonylamino)propyl-trimethyl-ammonium chloride
IUPAC Name: 3-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctylsulfonylamino)propyl-trimethylazanium chloride
SYSTEMATIC NAME: 3-[1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecakis(fluoranyl)octylsulfonylamino]propyl-trimethyl-azanium chloride
MOLECULAR FORMULA: C14H16ClF17N2O2S
MOLECULAR WEIGHT: 634.779894
SMILES: C[N+](C)(C)CCCNS(=O)(=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F.[Cl-]
Structure:
CAS RN: 936944-59-1
CAS Name: 3-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctylsulfonylamino)propyl-trimethylammonium chloride
OPENEYE Name: 3-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctylsulfonylamino)propyl-trimethyl-ammonium chloride
IUPAC Name: 3-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctylsulfonylamino)propyl-trimethylazanium chloride
SYSTEMATIC NAME: 3-[1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecakis(fluoranyl)octylsulfonylamino]propyl-trimethyl-azanium chloride
MOLECULAR FORMULA: C14H16ClF17N2O2S
MOLECULAR WEIGHT: 634.779894
SMILES: C[N+](C)(C)CCCNS(=O)(=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F.[Cl-]
Structure:
CAS RN: 37837-44-8
CAS Name: 2-[(phenylmethylene)amino]benzoic acid methyl ester
OPENEYE Name: methyl 2-(benzylideneamino)benzoate
IUPAC Name: methyl 2-(benzylideneamino)benzoate
SYSTEMATIC NAME: methyl 2-[(phenylmethylidene)amino]benzoate
MOLECULAR FORMULA: C15H13NO2
MOLECULAR WEIGHT: 239.26922
SMILES: COC(=O)C1=CC=CC=C1N=CC2=CC=CC=C2
Structure:
CAS RN: 446-22-0
CAS Name: (2S,3R,4R)-2-amino-3,4-dihydroxy-2-(hydroxymethyl)-14-oxoeicosanoic acid
OPENEYE Name: (2S,3R,4R)-2-amino-3,4-dihydroxy-2-(hydroxymethyl)-14-oxo-icosanoic acid
IUPAC Name: (2S,3R,4R)-2-amino-3,4-dihydroxy-2-(hydroxymethyl)-14-oxoicosanoic acid
SYSTEMATIC NAME: (2S,3R,4R)-2-azanyl-2-(hydroxymethyl)-3,4-bis(oxidanyl)-14-oxidanylidene-icosanoic acid
MOLECULAR FORMULA: C21H41NO6
MOLECULAR WEIGHT: 403.55334
SMILES: CCCCCCC(=O)CCCCCCCCC[C@H]([C@@H]([C@@](CO)(C(=O)O)N)O)O
Structure:
CAS RN: 4462-43-5
CAS Name: (2S,3R,4R)-2-amino-3,4-dihydroxy-2-(hydroxymethyl)-14-oxoeicosanoic acid
OPENEYE Name: (2S,3R,4R)-2-amino-3,4-dihydroxy-2-(hydroxymethyl)-14-oxo-icosanoic acid
IUPAC Name: (2S,3R,4R)-2-amino-3,4-dihydroxy-2-(hydroxymethyl)-14-oxoicosanoic acid
SYSTEMATIC NAME: (2S,3R,4R)-2-azanyl-2-(hydroxymethyl)-3,4-bis(oxidanyl)-14-oxidanylidene-icosanoic acid
MOLECULAR FORMULA: C21H41NO6
MOLECULAR WEIGHT: 403.55334
SMILES: CCCCCCC(=O)CCCCCCCCC[C@H]([C@@H]([C@@](CO)(C(=O)O)N)O)O
Structure:
CAS RN: 37734-45-5
CAS Name: chloromethanethioic acid S-(phenylmethyl) ester
OPENEYE Name: S-benzyl chloromethanethioate
IUPAC Name: S-benzyl chloromethanethioate
SYSTEMATIC NAME: S-(phenylmethyl) chloranylmethanethioate
MOLECULAR FORMULA: C8H7ClOS
MOLECULAR WEIGHT: 186.65858
SMILES: C1=CC=C(C=C1)CSC(=O)Cl
Structure:
CAS RN: 36393-56-3
CAS Name: (1R,2R)-2-amino-1-phenyl-1-propanol
OPENEYE Name: (1R,2R)-2-amino-1-phenyl-propan-1-ol
IUPAC Name: (1R,2R)-2-amino-1-phenylpropan-1-ol
SYSTEMATIC NAME: (1R,2R)-2-azanyl-1-phenyl-propan-1-ol
MOLECULAR FORMULA: C9H13NO
MOLECULAR WEIGHT: 151.20562
SMILES: C[C@H]([C@@H](C1=CC=CC=C1)O)N
Structure:
CAS RN: 37577-07-4
CAS Name: (1R,2R)-2-amino-1-phenyl-1-propanol
OPENEYE Name: (1R,2R)-2-amino-1-phenyl-propan-1-ol
IUPAC Name: (1R,2R)-2-amino-1-phenylpropan-1-ol
SYSTEMATIC NAME: (1R,2R)-2-azanyl-1-phenyl-propan-1-ol
MOLECULAR FORMULA: C9H13NO
MOLECULAR WEIGHT: 151.20562
SMILES: C[C@H]([C@@H](C1=CC=CC=C1)O)N
Structure:
CAS RN: 10579-82-5
CAS Name: dipotassium sulfide
OPENEYE Name: dipotassium sulfide
IUPAC Name: dipotassium sulfide
SYSTEMATIC NAME: dipotassium sulfide
MOLECULAR FORMULA: K2S
MOLECULAR WEIGHT: 110.2616
SMILES: [S-2].[K+].[K+]
Structure:
CAS RN: 12124-92-4
CAS Name: dipotassium sulfide
OPENEYE Name: dipotassium sulfide
IUPAC Name: dipotassium sulfide
SYSTEMATIC NAME: dipotassium sulfide
MOLECULAR FORMULA: K2S
MOLECULAR WEIGHT: 110.2616
SMILES: [S-2].[K+].[K+]
Structure:
CAS RN: 37364-67-3
CAS Name: 2-butan-2-yldioxybutane
OPENEYE Name: 2-sec-butylperoxybutane
IUPAC Name: 2-butan-2-ylperoxybutane
SYSTEMATIC NAME: 2-butan-2-ylperoxybutane
MOLECULAR FORMULA: C8H18O2
MOLECULAR WEIGHT: 146.22732
SMILES: CCC(C)OOC(C)CC
Structure:
CAS RN: 37294-49-8
CAS Name: disodium; 8-methyl-1-nonanol; 2-sulfobutanedioic acid
OPENEYE Name: disodium; 8-methylnonan-1-ol; 2-sulfobutanedioic acid
IUPAC Name: disodium; 8-methylnonan-1-ol; 2-sulfobutanedioic acid
SYSTEMATIC NAME: disodium; 8-methylnonan-1-ol; 2-sulfobutanedioic acid
MOLECULAR FORMULA: C14H28Na2O8S+2
MOLECULAR WEIGHT: 402.41186
SMILES: CC(C)CCCCCCCO.C(C(C(=O)O)S(=O)(=O)O)C(=O)O.[Na+].[Na+]
Structure:
CAS RN: 81180-19-0
CAS Name: disodium; 8-methyl-1-nonanol; 2-sulfobutanedioic acid
OPENEYE Name: disodium; 8-methylnonan-1-ol; 2-sulfobutanedioic acid
IUPAC Name: disodium; 8-methylnonan-1-ol; 2-sulfobutanedioic acid
SYSTEMATIC NAME: disodium; 8-methylnonan-1-ol; 2-sulfobutanedioic acid
MOLECULAR FORMULA: C14H28Na2O8S+2
MOLECULAR WEIGHT: 402.41186
SMILES: CC(C)CCCCCCCO.C(C(C(=O)O)S(=O)(=O)O)C(=O)O.[Na+].[Na+]
Structure:
CAS RN: 16092-34-5
CAS Name: dicopper disodium 3-[5-(methylsulfamoyl)-2-oxidophenyl]azo-7-[[6-[5-(methylsulfamoyl)-2-oxidophenyl]azo-5-oxido-7-sulfonato-2-naphthalenyl]amino]-4-oxido-2-naphthalenesulfonate
OPENEYE Name: dicopper disodium 3-[5-(methylsulfamoyl)-2-oxido-phenyl]azo-7-[[6-[5-(methylsulfamoyl)-2-oxido-phenyl]azo-5-oxido-7-sulfonato-2-naphthyl]amino]-4-oxido-naphthalene-2-sulfonate
IUPAC Name: dicopper disodium 3-[[5-(methylsulfamoyl)-2-oxidophenyl]diazenyl]-7-[[6-[[5-(methylsulfamoyl)-2-oxidophenyl]diazenyl]-5-oxido-7-sulfonatonaphthalen-2-yl]amino]-4-oxidonaphthalene-2-sulfonate
SYSTEMATIC NAME: dicopper disodium 3-[[5-(methylsulfamoyl)-2-oxidanidyl-phenyl]diazenyl]-7-[[6-[[5-(methylsulfamoyl)-2-oxidanidyl-phenyl]diazenyl]-5-oxidanidyl-7-sulfonato-naphthalen-2-yl]amino]-4-oxidanidyl-naphthalene-2-sulfonate
MOLECULAR FORMULA: C34H23Cu2N7Na2O14S4
MOLECULAR WEIGHT: 1054.91646
SMILES: CNS(=O)(=O)C1=CC(=C(C=C1)[O-])N=NC2=C(C=C3C=C(C=CC3=C2[O-])NC4=CC5=CC(=C(C(=C5C=C4)[O-])N=NC6=C(C=CC(=C6)S(=O)(=O)NC)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Cu+2].[Cu+2]
Structure:
CAS RN: 39290-88-5
CAS Name: dicopper disodium 3-[5-(methylsulfamoyl)-2-oxidophenyl]azo-7-[[6-[5-(methylsulfamoyl)-2-oxidophenyl]azo-5-oxido-7-sulfonato-2-naphthalenyl]amino]-4-oxido-2-naphthalenesulfonate
OPENEYE Name: dicopper disodium 3-[5-(methylsulfamoyl)-2-oxido-phenyl]azo-7-[[6-[5-(methylsulfamoyl)-2-oxido-phenyl]azo-5-oxido-7-sulfonato-2-naphthyl]amino]-4-oxido-naphthalene-2-sulfonate
IUPAC Name: dicopper disodium 3-[[5-(methylsulfamoyl)-2-oxidophenyl]diazenyl]-7-[[6-[[5-(methylsulfamoyl)-2-oxidophenyl]diazenyl]-5-oxido-7-sulfonatonaphthalen-2-yl]amino]-4-oxidonaphthalene-2-sulfonate
SYSTEMATIC NAME: dicopper disodium 3-[[5-(methylsulfamoyl)-2-oxidanidyl-phenyl]diazenyl]-7-[[6-[[5-(methylsulfamoyl)-2-oxidanidyl-phenyl]diazenyl]-5-oxidanidyl-7-sulfonato-naphthalen-2-yl]amino]-4-oxidanidyl-naphthalene-2-sulfonate
MOLECULAR FORMULA: C34H23Cu2N7Na2O14S4
MOLECULAR WEIGHT: 1054.91646
SMILES: CNS(=O)(=O)C1=CC(=C(C=C1)[O-])N=NC2=C(C=C3C=C(C=CC3=C2[O-])NC4=CC5=CC(=C(C(=C5C=C4)[O-])N=NC6=C(C=CC(=C6)S(=O)(=O)NC)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Cu+2].[Cu+2]
Structure:
CAS RN: 170173-23-6
CAS Name: 2-methyloxirane; octadecanoate; oxirane
OPENEYE Name: 2-methyloxirane; octadecanoate; oxirane
IUPAC Name: 2-methyloxirane; octadecanoate; oxirane
SYSTEMATIC NAME: 2-methyloxirane; octadecanoate; oxirane
MOLECULAR FORMULA: C23H45O4-
MOLECULAR WEIGHT: 385.601
SMILES: CCCCCCCCCCCCCCCCCC(=O)[O-].CC1CO1.C1CO1
Structure:
CAS RN: 170551-75-4
CAS Name: 2-methyloxirane; octadecanoate; oxirane
OPENEYE Name: 2-methyloxirane; octadecanoate; oxirane
IUPAC Name: 2-methyloxirane; octadecanoate; oxirane
SYSTEMATIC NAME: 2-methyloxirane; octadecanoate; oxirane
MOLECULAR FORMULA: C23H45O4-
MOLECULAR WEIGHT: 385.601
SMILES: CCCCCCCCCCCCCCCCCC(=O)[O-].CC1CO1.C1CO1
Structure:
CAS RN: 37231-60-0
CAS Name: 2-methyloxirane; octadecanoate; oxirane
OPENEYE Name: 2-methyloxirane; octadecanoate; oxirane
IUPAC Name: 2-methyloxirane; octadecanoate; oxirane
SYSTEMATIC NAME: 2-methyloxirane; octadecanoate; oxirane
MOLECULAR FORMULA: C23H45O4-
MOLECULAR WEIGHT: 385.601
SMILES: CCCCCCCCCCCCCCCCCC(=O)[O-].CC1CO1.C1CO1
Structure:
CAS RN: 53026-65-6
CAS Name: 2-methyloxirane; octadecanoate; oxirane
OPENEYE Name: 2-methyloxirane; octadecanoate; oxirane
IUPAC Name: 2-methyloxirane; octadecanoate; oxirane
SYSTEMATIC NAME: 2-methyloxirane; octadecanoate; oxirane
MOLECULAR FORMULA: C23H45O4-
MOLECULAR WEIGHT: 385.601
SMILES: CCCCCCCCCCCCCCCCCC(=O)[O-].CC1CO1.C1CO1
Structure:
CAS RN: 59650-75-8
CAS Name: 2-methyloxirane; octadecanoate; oxirane
OPENEYE Name: 2-methyloxirane; octadecanoate; oxirane
IUPAC Name: 2-methyloxirane; octadecanoate; oxirane
SYSTEMATIC NAME: 2-methyloxirane; octadecanoate; oxirane
MOLECULAR FORMULA: C23H45O4-
MOLECULAR WEIGHT: 385.601
SMILES: CCCCCCCCCCCCCCCCCC(=O)[O-].CC1CO1.C1CO1
Structure:
CAS RN: 9009-38-5
CAS Name: 2-methyloxirane; octadecanoate; oxirane
OPENEYE Name: 2-methyloxirane; octadecanoate; oxirane
IUPAC Name: 2-methyloxirane; octadecanoate; oxirane
SYSTEMATIC NAME: 2-methyloxirane; octadecanoate; oxirane
MOLECULAR FORMULA: C23H45O4-
MOLECULAR WEIGHT: 385.601
SMILES: CCCCCCCCCCCCCCCCCC(=O)[O-].CC1CO1.C1CO1
Structure:
CAS RN: 4205-52-1
CAS Name: (2R,5R)-hexane-2,5-diamine
OPENEYE Name: (2R,5R)-hexane-2,5-diamine
IUPAC Name: (2R,5R)-hexane-2,5-diamine
SYSTEMATIC NAME: (2R,5R)-hexane-2,5-diamine
MOLECULAR FORMULA: C6H16N2
MOLECULAR WEIGHT: 116.20464
SMILES: C[C@H](CC[C@@H](C)N)N
Structure:
CAS RN: 42052-44-8
CAS Name: (2R,5R)-hexane-2,5-diamine
OPENEYE Name: (2R,5R)-hexane-2,5-diamine
IUPAC Name: (2R,5R)-hexane-2,5-diamine
SYSTEMATIC NAME: (2R,5R)-hexane-2,5-diamine
MOLECULAR FORMULA: C6H16N2
MOLECULAR WEIGHT: 116.20464
SMILES: C[C@H](CC[C@@H](C)N)N
Structure:
No comments:
Post a Comment