CAS RN: 58-81-1
CAS Name: 2,4,6-trichloro-5-propylpyrimidine
OPENEYE Name: 2,4,6-trichloro-5-propyl-pyrimidine
IUPAC Name: 2,4,6-trichloro-5-propylpyrimidine
SYSTEMATIC NAME: 2,4,6-tris(chloranyl)-5-propyl-pyrimidine
MOLECULAR FORMULA: C7H7Cl3N2
MOLECULAR WEIGHT: 225.50288
SMILES: CCCC1=C(N=C(N=C1Cl)Cl)Cl
Structure:
CAS RN: 16397-19-6
CAS Name: 2-amino-1-hexanol
OPENEYE Name: 2-aminohexan-1-ol
IUPAC Name: 2-aminohexan-1-ol
SYSTEMATIC NAME: 2-azanylhexan-1-ol
MOLECULAR FORMULA: C6H15NO
MOLECULAR WEIGHT: 117.1894
SMILES: CCCCC(CO)N
Structure:
CAS RN: 88378-50-1
CAS Name: acetic acid [2-[[(2-acetyloxy-3,5-dichlorophenyl)methyl-methylamino]methyl]-4,6-dimethylphenyl] ester; 2,4,6-trinitrophenol
OPENEYE Name: [2-[[(2-acetoxy-3,5-dichloro-phenyl)methyl-methyl-amino]methyl]-4,6-dimethyl-phenyl] acetate; picric acid
IUPAC Name: [2-[[(2-acetyloxy-3,5-dichlorophenyl)methyl-methylamino]methyl]-4,6-dimethylphenyl] acetate; 2,4,6-trinitrophenol
SYSTEMATIC NAME: [2-[[[2-acetyloxy-3,5-bis(chloranyl)phenyl]methyl-methyl-amino]methyl]-4,6-dimethyl-phenyl] ethanoate; 2,4,6-trinitrophenol
MOLECULAR FORMULA: C27H26Cl2N4O11
MOLECULAR WEIGHT: 653.42154
SMILES: CC1=CC(=C(C(=C1)CN(C)CC2=CC(=CC(=C2OC(=O)C)Cl)Cl)OC(=O)C)C.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]
Structure:
CAS RN: 14985-26-3
CAS Name: (2S,3S)-2-(4-nitrophenyl)-3-phenyloxirane
OPENEYE Name: (2S,3S)-2-(4-nitrophenyl)-3-phenyl-oxirane
IUPAC Name: (2S,3S)-2-(4-nitrophenyl)-3-phenyloxirane
SYSTEMATIC NAME: (2S,3S)-2-(4-nitrophenyl)-3-phenyl-oxirane
MOLECULAR FORMULA: C14H11NO3
MOLECULAR WEIGHT: 241.24204
SMILES: C1=CC=C(C=C1)[C@H]2[C@@H](O2)C3=CC=C(C=C3)[N+](=O)[O-]
Structure:
CAS RN: 7251-43-6
CAS Name: 4a,8-dibromo-5,10a-dihydro-1H-pyrimido[5,4-b]quinoline-2,4,10-trione
OPENEYE Name: 4a,8-dibromo-5,10a-dihydro-1H-pyrimido[5,4-b]quinoline-2,4,10-trione
IUPAC Name: 4a,8-dibromo-5,10a-dihydro-1H-pyrimido[5,4-b]quinoline-2,4,10-trione
SYSTEMATIC NAME: 4a,8-bis(bromanyl)-5,10a-dihydro-1H-pyrimido[5,4-b]quinoline-2,4,10-trione
MOLECULAR FORMULA: C11H7Br2N3O3
MOLECULAR WEIGHT: 388.99958
SMILES: C1=CC2=C(C=C1Br)C(=O)C3C(N2)(C(=O)NC(=O)N3)Br
Structure:
CAS RN: 6964-59-6
CAS Name: 4a-bromo-8-methoxy-5,10a-dihydro-1H-pyrimido[5,4-b]quinoline-2,4,10-trione
OPENEYE Name: 4a-bromo-8-methoxy-5,10a-dihydro-1H-pyrimido[5,4-b]quinoline-2,4,10-trione
IUPAC Name: 4a-bromo-8-methoxy-5,10a-dihydro-1H-pyrimido[5,4-b]quinoline-2,4,10-trione
SYSTEMATIC NAME: 4a-bromanyl-8-methoxy-5,10a-dihydro-1H-pyrimido[5,4-b]quinoline-2,4,10-trione
MOLECULAR FORMULA: C12H10BrN3O4
MOLECULAR WEIGHT: 340.1295
SMILES: COC1=CC2=C(C=C1)NC3(C(C2=O)NC(=O)NC3=O)Br
Structure:
CAS RN: 22180-02-5
CAS Name: 4-(4-methylphenoxy)butanoic acid
OPENEYE Name: 4-(4-methylphenoxy)butanoic acid
IUPAC Name: 4-(4-methylphenoxy)butanoic acid
SYSTEMATIC NAME: 4-(4-methylphenoxy)butanoic acid
MOLECULAR FORMULA: C11H14O3
MOLECULAR WEIGHT: 194.22706
SMILES: CC1=CC=C(C=C1)OCCCC(=O)O
Structure:
CAS RN: 21539-47-9
CAS Name: 3-(ethylamino)propanenitrile
OPENEYE Name: 3-(ethylamino)propanenitrile
IUPAC Name: 3-(ethylamino)propanenitrile
SYSTEMATIC NAME: 3-(ethylamino)propanenitrile
MOLECULAR FORMULA: C5H10N2
MOLECULAR WEIGHT: 98.1463
SMILES: CCNCCC#N
Structure:
CAS RN: 18705-85-6
CAS Name: 2-[[2-acetamido-3-[4-[bis(2-chloroethyl)amino]phenyl]-1-oxopropyl]amino]-3-methylbutanoic acid ethyl ester
OPENEYE Name: ethyl 2-[[2-acetamido-3-[4-[bis(2-chloroethyl)amino]phenyl]propanoyl]amino]-3-methyl-butanoate
IUPAC Name: ethyl 2-[[2-acetamido-3-[4-[bis(2-chloroethyl)amino]phenyl]propanoyl]amino]-3-methylbutanoate
SYSTEMATIC NAME: ethyl 2-[[2-acetamido-3-[4-[bis(2-chloroethyl)amino]phenyl]propanoyl]amino]-3-methyl-butanoate
MOLECULAR FORMULA: C22H33Cl2N3O4
MOLECULAR WEIGHT: 474.42112
SMILES: CCOC(=O)C(C(C)C)NC(=O)C(CC1=CC=C(C=C1)N(CCCl)CCCl)NC(=O)C
Structure:
CAS RN: 531-77-1
CAS Name: 2-[[2-acetamido-3-[4-[bis(2-chloroethyl)amino]phenyl]-1-oxopropyl]amino]-3-methylbutanoic acid ethyl ester
OPENEYE Name: ethyl 2-[[2-acetamido-3-[4-[bis(2-chloroethyl)amino]phenyl]propanoyl]amino]-3-methyl-butanoate
IUPAC Name: ethyl 2-[[2-acetamido-3-[4-[bis(2-chloroethyl)amino]phenyl]propanoyl]amino]-3-methylbutanoate
SYSTEMATIC NAME: ethyl 2-[[2-acetamido-3-[4-[bis(2-chloroethyl)amino]phenyl]propanoyl]amino]-3-methyl-butanoate
MOLECULAR FORMULA: C22H33Cl2N3O4
MOLECULAR WEIGHT: 474.42112
SMILES: CCOC(=O)C(C(C)C)NC(=O)C(CC1=CC=C(C=C1)N(CCCl)CCCl)NC(=O)C
Structure:
CAS RN: 18357-78-3
CAS Name: (4R)-4-[(3R,5R,8S,9S,10S,12S,13R,14S,17R)-3,12-dihydroxy-10,13-dimethyl-11-oxo-1,2,3,4,5,6,7,8,9,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pentanoic acid
OPENEYE Name: (4R)-4-[(3R,5R,8S,9S,10S,12S,13R,14S,17R)-3,12-dihydroxy-10,13-dimethyl-11-oxo-1,2,3,4,5,6,7,8,9,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pentanoic acid
IUPAC Name: (4R)-4-[(3R,5R,8S,9S,10S,12S,13R,14S,17R)-3,12-dihydroxy-10,13-dimethyl-11-oxo-1,2,3,4,5,6,7,8,9,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pentanoic acid
SYSTEMATIC NAME: (4R)-4-[(3R,5R,8S,9S,10S,12S,13R,14S,17R)-10,13-dimethyl-3,12-bis(oxidanyl)-11-oxidanylidene-1,2,3,4,5,6,7,8,9,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pentanoic acid
MOLECULAR FORMULA: C24H38O5
MOLECULAR WEIGHT: 406.55552
SMILES: C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1([C@@H](C(=O)[C@H]3[C@H]2CC[C@H]4[C@@]3(CC[C@H](C4)O)C)O)C
Structure:
CAS RN: 91211-34-6
CAS Name: N4-(3,4-dibromophenyl)-5-nitrosopyrimidine-2,4,6-triamine
OPENEYE Name: N4-(3,4-dibromophenyl)-5-nitroso-pyrimidine-2,4,6-triamine
IUPAC Name: 4-N-(3,4-dibromophenyl)-5-nitrosopyrimidine-2,4,6-triamine
SYSTEMATIC NAME: N4-[3,4-bis(bromanyl)phenyl]-5-nitroso-pyrimidine-2,4,6-triamine
MOLECULAR FORMULA: C10H8Br2N6O
MOLECULAR WEIGHT: 388.01812
SMILES: C1=CC(=C(C=C1NC2=NC(=NC(=C2N=O)N)N)Br)Br
Structure:
CAS RN: 6971-59-1
CAS Name: N4-(4-bromo-2-methylphenyl)-5-nitrosopyrimidine-2,4,6-triamine
OPENEYE Name: N4-(4-bromo-2-methyl-phenyl)-5-nitroso-pyrimidine-2,4,6-triamine
IUPAC Name: 4-N-(4-bromo-2-methylphenyl)-5-nitrosopyrimidine-2,4,6-triamine
SYSTEMATIC NAME: N4-(4-bromanyl-2-methyl-phenyl)-5-nitroso-pyrimidine-2,4,6-triamine
MOLECULAR FORMULA: C11H11BrN6O
MOLECULAR WEIGHT: 323.14864
SMILES: CC1=C(C=CC(=C1)Br)NC2=NC(=NC(=C2N=O)N)N
Structure:
CAS RN: 175205-20-6
CAS Name: 2-[1-[(4-chlorophenyl)methyl]-2-ethyl-5-methyl-3-indolyl]acetic acid
OPENEYE Name: 2-[1-[(4-chlorophenyl)methyl]-2-ethyl-5-methyl-indol-3-yl]acetic acid
IUPAC Name: 2-[1-[(4-chlorophenyl)methyl]-2-ethyl-5-methylindol-3-yl]acetic acid
SYSTEMATIC NAME: 2-[1-[(4-chlorophenyl)methyl]-2-ethyl-5-methyl-indol-3-yl]ethanoic acid
MOLECULAR FORMULA: C20H20ClNO2
MOLECULAR WEIGHT: 341.8313
SMILES: CCC1=C(C2=C(N1CC3=CC=C(C=C3)Cl)C=CC(=C2)C)CC(=O)O
Structure:
CAS RN: 89518-35-4
CAS Name: (2-acetyl-3-oxobut-1-enyl)urea
OPENEYE Name: (2-acetyl-3-oxo-but-1-enyl)urea
IUPAC Name: (2-acetyl-3-oxobut-1-enyl)urea
SYSTEMATIC NAME: 1-(2-ethanoyl-3-oxidanylidene-but-1-enyl)urea
MOLECULAR FORMULA: C7H10N2O3
MOLECULAR WEIGHT: 170.1659
SMILES: CC(=O)C(=CNC(=O)N)C(=O)C
Structure:
CAS RN: 6971-48-8
CAS Name: N-carbamoyl-3-nitrobenzamide
OPENEYE Name: N-carbamoyl-3-nitro-benzamide
IUPAC Name: N-carbamoyl-3-nitrobenzamide
SYSTEMATIC NAME: N-aminocarbonyl-3-nitro-benzamide
MOLECULAR FORMULA: C8H7N3O4
MOLECULAR WEIGHT: 209.15888
SMILES: C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)NC(=O)N
Structure:
CAS RN: 4068-75-1
CAS Name: 2-hydroxy-5-iodobenzoic acid methyl ester
OPENEYE Name: methyl 2-hydroxy-5-iodo-benzoate
IUPAC Name: methyl 2-hydroxy-5-iodobenzoate
SYSTEMATIC NAME: methyl 5-iodanyl-2-oxidanyl-benzoate
MOLECULAR FORMULA: C8H7IO3
MOLECULAR WEIGHT: 278.04385
SMILES: COC(=O)C1=C(C=CC(=C1)I)O
Structure:
CAS RN: 65695-97-8
CAS Name: phosphoric acid tris(2,3-dimethylphenyl) ester
OPENEYE Name: tris(2,3-dimethylphenyl) phosphate
IUPAC Name: tris(2,3-dimethylphenyl) phosphate
SYSTEMATIC NAME: tris(2,3-dimethylphenyl) phosphate
MOLECULAR FORMULA: C24H27O4P
MOLECULAR WEIGHT: 410.442541
SMILES: CC1=C(C(=CC=C1)OP(=O)(OC2=CC=CC(=C2C)C)OC3=CC=CC(=C3C)C)C
Structure:
CAS RN: 838-59-5
CAS Name: 1-(1-phenylethylthio)ethylbenzene
OPENEYE Name: 1-(1-phenylethylsulfanyl)ethylbenzene
IUPAC Name: 1-(1-phenylethylsulfanyl)ethylbenzene
SYSTEMATIC NAME: 1-(1-phenylethylsulfanyl)ethylbenzene
MOLECULAR FORMULA: C16H18S
MOLECULAR WEIGHT: 242.37912
SMILES: CC(C1=CC=CC=C1)SC(C)C2=CC=CC=C2
Structure:
CAS RN: 3862-11-1
CAS Name: phosphoric acid tris(3,4-dimethylphenyl) ester
OPENEYE Name: tris(3,4-dimethylphenyl) phosphate
IUPAC Name: tris(3,4-dimethylphenyl) phosphate
SYSTEMATIC NAME: tris(3,4-dimethylphenyl) phosphate
MOLECULAR FORMULA: C24H27O4P
MOLECULAR WEIGHT: 410.442541
SMILES: CC1=C(C=C(C=C1)OP(=O)(OC2=CC(=C(C=C2)C)C)OC3=CC(=C(C=C3)C)C)C
Structure:
CAS RN: 6955-48-2
CAS Name: 2-methylbenzenesulfonic acid (1,1-dioxo-2,3-dihydro-1,2-benzothiazol-3-yl) ester
OPENEYE Name: (1,1-dioxo-2,3-dihydro-1,2-benzothiazol-3-yl) 2-methylbenzenesulfonate
IUPAC Name: (1,1-dioxo-2,3-dihydro-1,2-benzothiazol-3-yl) 2-methylbenzenesulfonate
SYSTEMATIC NAME: [1,1-bis(oxidanylidene)-2,3-dihydro-1,2-benzothiazol-3-yl] 2-methylbenzenesulfonate
MOLECULAR FORMULA: C14H13NO5S2
MOLECULAR WEIGHT: 339.38672
SMILES: CC1=CC=CC=C1S(=O)(=O)OC2C3=CC=CC=C3S(=O)(=O)N2
Structure:
CAS RN: 87011-53-8
CAS Name: 2-methylbenzenesulfonic acid (1,1-dioxo-2,3-dihydro-1,2-benzothiazol-3-yl) ester
OPENEYE Name: (1,1-dioxo-2,3-dihydro-1,2-benzothiazol-3-yl) 2-methylbenzenesulfonate
IUPAC Name: (1,1-dioxo-2,3-dihydro-1,2-benzothiazol-3-yl) 2-methylbenzenesulfonate
SYSTEMATIC NAME: [1,1-bis(oxidanylidene)-2,3-dihydro-1,2-benzothiazol-3-yl] 2-methylbenzenesulfonate
MOLECULAR FORMULA: C14H13NO5S2
MOLECULAR WEIGHT: 339.38672
SMILES: CC1=CC=CC=C1S(=O)(=O)OC2C3=CC=CC=C3S(=O)(=O)N2
Structure:
CAS RN: 87027-09-6
CAS Name: (4aS,8aS)-N-phenyl-3,4,4a,5,6,7,8,8a-octahydro-2H-quinoline-1-carboxamide
OPENEYE Name: (4aS,8aS)-N-phenyl-3,4,4a,5,6,7,8,8a-octahydro-2H-quinoline-1-carboxamide
IUPAC Name: (4aS,8aS)-N-phenyl-3,4,4a,5,6,7,8,8a-octahydro-2H-quinoline-1-carboxamide
SYSTEMATIC NAME: (4aS,8aS)-N-phenyl-3,4,4a,5,6,7,8,8a-octahydro-2H-quinoline-1-carboxamide
MOLECULAR FORMULA: C16H22N2O
MOLECULAR WEIGHT: 258.35868
SMILES: C1CC[C@H]2[C@@H](C1)CCCN2C(=O)NC3=CC=CC=C3
Structure:
CAS RN: 6964-04-1
CAS Name: 3-methylheptane-2,4-diol
OPENEYE Name: 3-methylheptane-2,4-diol
IUPAC Name: 3-methylheptane-2,4-diol
SYSTEMATIC NAME: 3-methylheptane-2,4-diol
MOLECULAR FORMULA: C8H18O2
MOLECULAR WEIGHT: 146.22732
SMILES: CCCC(C(C)C(C)O)O
Structure:
CAS RN: 6979-94-8
CAS Name: acetic acid [3,4-diacetyloxy-5-(2-amino-6-oxo-3H-purin-9-yl)-2-oxolanyl]methyl ester
OPENEYE Name: [3,4-diacetoxy-5-(2-amino-6-oxo-3H-purin-9-yl)tetrahydrofuran-2-yl]methyl acetate
IUPAC Name: [3,4-diacetyloxy-5-(2-amino-6-oxo-3H-purin-9-yl)oxolan-2-yl]methyl acetate
SYSTEMATIC NAME: [3,4-diacetyloxy-5-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)oxolan-2-yl]methyl ethanoate
MOLECULAR FORMULA: C16H19N5O8
MOLECULAR WEIGHT: 409.35076
SMILES: CC(=O)OCC1C(C(C(O1)N2C=NC3=C2NC(=NC3=O)N)OC(=O)C)OC(=O)C
Structure:
CAS RN: 27460-40-8
CAS Name: acetic acid [3,4-diacetyloxy-5-(2-amino-6-oxo-3H-purin-9-yl)-2-oxolanyl]methyl ester
OPENEYE Name: [3,4-diacetoxy-5-(2-amino-6-oxo-3H-purin-9-yl)tetrahydrofuran-2-yl]methyl acetate
IUPAC Name: [3,4-diacetyloxy-5-(2-amino-6-oxo-3H-purin-9-yl)oxolan-2-yl]methyl acetate
SYSTEMATIC NAME: [3,4-diacetyloxy-5-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)oxolan-2-yl]methyl ethanoate
MOLECULAR FORMULA: C16H19N5O8
MOLECULAR WEIGHT: 409.35076
SMILES: CC(=O)OCC1C(C(C(O1)N2C=NC3=C2NC(=NC3=O)N)OC(=O)C)OC(=O)C
Structure:
CAS RN: 3181-38-2
CAS Name: acetic acid [3,4-diacetyloxy-5-(6-oxo-3H-purin-9-yl)-2-oxolanyl]methyl ester
OPENEYE Name: [3,4-diacetoxy-5-(6-oxo-3H-purin-9-yl)tetrahydrofuran-2-yl]methyl acetate
IUPAC Name: [3,4-diacetyloxy-5-(6-oxo-3H-purin-9-yl)oxolan-2-yl]methyl acetate
SYSTEMATIC NAME: [3,4-diacetyloxy-5-(6-oxidanylidene-3H-purin-9-yl)oxolan-2-yl]methyl ethanoate
MOLECULAR FORMULA: C16H18N4O8
MOLECULAR WEIGHT: 394.33612
SMILES: CC(=O)OCC1C(C(C(O1)N2C=NC3=C2NC=NC3=O)OC(=O)C)OC(=O)C
Structure:
CAS RN: 28069-16-1
CAS Name: acetic acid [3,4-diacetyloxy-5-(6-oxo-3H-purin-9-yl)-2-oxolanyl]methyl ester
OPENEYE Name: [3,4-diacetoxy-5-(6-oxo-3H-purin-9-yl)tetrahydrofuran-2-yl]methyl acetate
IUPAC Name: [3,4-diacetyloxy-5-(6-oxo-3H-purin-9-yl)oxolan-2-yl]methyl acetate
SYSTEMATIC NAME: [3,4-diacetyloxy-5-(6-oxidanylidene-3H-purin-9-yl)oxolan-2-yl]methyl ethanoate
MOLECULAR FORMULA: C16H18N4O8
MOLECULAR WEIGHT: 394.33612
SMILES: CC(=O)OCC1C(C(C(O1)N2C=NC3=C2NC=NC3=O)OC(=O)C)OC(=O)C
Structure:
CAS RN: 7803-88-5
CAS Name: 2-(2-amino-6-methoxy-9-purinyl)-5-(hydroxymethyl)oxolane-3,4-diol
OPENEYE Name: 2-(2-amino-6-methoxy-purin-9-yl)-5-(hydroxymethyl)tetrahydrofuran-3,4-diol
IUPAC Name: 2-(2-amino-6-methoxypurin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol
SYSTEMATIC NAME: 2-(2-azanyl-6-methoxy-purin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol
MOLECULAR FORMULA: C11H15N5O5
MOLECULAR WEIGHT: 297.2673
SMILES: COC1=NC(=NC2=C1N=CN2C3C(C(C(O3)CO)O)O)N
Structure:
CAS RN: 34793-34-5
CAS Name: 2-(2-amino-6-methoxy-9-purinyl)-5-(hydroxymethyl)oxolane-3,4-diol
OPENEYE Name: 2-(2-amino-6-methoxy-purin-9-yl)-5-(hydroxymethyl)tetrahydrofuran-3,4-diol
IUPAC Name: 2-(2-amino-6-methoxypurin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol
SYSTEMATIC NAME: 2-(2-azanyl-6-methoxy-purin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol
MOLECULAR FORMULA: C11H15N5O5
MOLECULAR WEIGHT: 297.2673
SMILES: COC1=NC(=NC2=C1N=CN2C3C(C(C(O3)CO)O)O)N
Structure:
CAS RN: 566-78-9
CAS Name: acetic acid [2-[(3S,8S,9S,10R,13S,14S,17S)-3-hydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] ester
OPENEYE Name: [2-[(3S,8S,9S,10R,13S,14S,17S)-3-hydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-oxo-ethyl] acetate
IUPAC Name: [2-[(3S,8S,9S,10R,13S,14S,17S)-3-hydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate
SYSTEMATIC NAME: [2-[(3S,8S,9S,10R,13S,14S,17S)-10,13-dimethyl-3-oxidanyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-oxidanylidene-ethyl] ethanoate
MOLECULAR FORMULA: C23H34O4
MOLECULAR WEIGHT: 374.51366
SMILES: CC(=O)OCC(=O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)O)C)C
Structure:
CAS RN: 17973-86-3
CAS Name: 3,6-dibromopyridazine
OPENEYE Name: 3,6-dibromopyridazine
IUPAC Name: 3,6-dibromopyridazine
SYSTEMATIC NAME: 3,6-bis(bromanyl)pyridazine
MOLECULAR FORMULA: C4H2Br2N2
MOLECULAR WEIGHT: 237.88008
SMILES: C1=CC(=NN=C1Br)Br
Structure:
CAS RN: 13373-28-9
CAS Name: 6-nitro-2-oxo-1-benzopyran-3-carboxylic acid ethyl ester
OPENEYE Name: ethyl 6-nitro-2-oxo-chromene-3-carboxylate
IUPAC Name: ethyl 6-nitro-2-oxochromene-3-carboxylate
SYSTEMATIC NAME: ethyl 6-nitro-2-oxidanylidene-chromene-3-carboxylate
MOLECULAR FORMULA: C12H9NO6
MOLECULAR WEIGHT: 263.20296
SMILES: CCOC(=O)C1=CC2=C(C=CC(=C2)[N+](=O)[O-])OC1=O
Structure:
CAS RN: 6964-11-0
CAS Name: 2-amino-1-methyl-5-(phenylmethylene)-4-imidazolone
OPENEYE Name: 2-amino-5-benzylidene-1-methyl-imidazol-4-one
IUPAC Name: 2-amino-5-benzylidene-1-methylimidazol-4-one
SYSTEMATIC NAME: 2-azanyl-1-methyl-5-(phenylmethylidene)imidazol-4-one
MOLECULAR FORMULA: C11H11N3O
MOLECULAR WEIGHT: 201.22454
SMILES: CN1C(=CC2=CC=CC=C2)C(=O)N=C1N
Structure:
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