CAS RN: 27585-04-2
CAS Name: 2,7-dichloro-N-methyl-5-imidazo[1,2-c]pyrimidinamine
OPENEYE Name: 2,7-dichloro-N-methyl-imidazo[1,2-c]pyrimidin-5-amine
IUPAC Name: 2,7-dichloro-N-methylimidazo[1,2-c]pyrimidin-5-amine
SYSTEMATIC NAME: 2,7-bis(chloranyl)-N-methyl-imidazo[1,2-c]pyrimidin-5-amine
MOLECULAR FORMULA: C7H6Cl2N4
MOLECULAR WEIGHT: 217.05534
SMILES: CNC1=NC(=CC2=NC(=CN21)Cl)Cl
Structure:
CAS RN: 23418-85-1
CAS Name: 4-methylbenzenesulfonic acid but-3-ynyl ester
OPENEYE Name: but-3-ynyl 4-methylbenzenesulfonate
IUPAC Name: but-3-ynyl 4-methylbenzenesulfonate
SYSTEMATIC NAME: but-3-ynyl 4-methylbenzenesulfonate
MOLECULAR FORMULA: C11H12O3S
MOLECULAR WEIGHT: 224.27618
SMILES: CC1=CC=C(C=C1)S(=O)(=O)OCCC#C
Structure:
CAS RN: 4442-94-8
CAS Name: 2-cyclohexyl-2-hydroxyacetic acid
OPENEYE Name: 2-cyclohexyl-2-hydroxy-acetic acid
IUPAC Name: 2-cyclohexyl-2-hydroxyacetic acid
SYSTEMATIC NAME: 2-cyclohexyl-2-oxidanyl-ethanoic acid
MOLECULAR FORMULA: C8H14O3
MOLECULAR WEIGHT: 158.19496
SMILES: C1CCC(CC1)C(C(=O)O)O
Structure:
CAS RN: 938-79-4
CAS Name: 2-cyclopentyl-2-hydroxy-3-hexynoic acid ethyl ester
OPENEYE Name: ethyl 2-cyclopentyl-2-hydroxy-hex-3-ynoate
IUPAC Name: ethyl 2-cyclopentyl-2-hydroxyhex-3-ynoate
SYSTEMATIC NAME: ethyl 2-cyclopentyl-2-oxidanyl-hex-3-ynoate
MOLECULAR FORMULA: C13H20O3
MOLECULAR WEIGHT: 224.2961
SMILES: CCC#CC(C1CCCC1)(C(=O)OCC)O
Structure:
CAS RN: 20691-89-8
CAS Name: (1-methyl-4-piperidinyl)methanol
OPENEYE Name: (1-methyl-4-piperidyl)methanol
IUPAC Name: (1-methylpiperidin-4-yl)methanol
SYSTEMATIC NAME: (1-methylpiperidin-4-yl)methanol
MOLECULAR FORMULA: C7H15NO
MOLECULAR WEIGHT: 129.2001
SMILES: CN1CCC(CC1)CO
Structure:
CAS RN: 6093-80-7
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C45H72O16
MOLECULAR WEIGHT: 869.04358
SMILES: CC1CCC2(C(C3C(O2)CC4C3(CCC5C4CC=C6C5(CCC(C6)OC7C(C(C(C(O7)CO)OC8C(C(C(C(O8)C)O)O)O)O)OC9C(C(C(C(O9)C)O)O)O)C)C)C)OC1
Structure:
CAS RN: 3517-42-8
CAS Name: acetic acid [2-(3-acetyloxy-17-hydroxy-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl)-2-oxoethyl] ester
OPENEYE Name: [2-(3-acetoxy-17-hydroxy-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl)-2-oxo-ethyl] acetate
IUPAC Name: [2-(3-acetyloxy-17-hydroxy-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl)-2-oxoethyl] acetate
SYSTEMATIC NAME: [2-(3-acetyloxy-10,13-dimethyl-17-oxidanyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl)-2-oxidanylidene-ethyl] ethanoate
MOLECULAR FORMULA: C25H36O6
MOLECULAR WEIGHT: 432.54974
SMILES: CC(=O)OCC(=O)C1(CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC(=O)C)C)C)O
Structure:
CAS RN: 32560-24-0
CAS Name: 1-(2-chloroethyl)-4-methylbenzene
OPENEYE Name: 1-(2-chloroethyl)-4-methyl-benzene
IUPAC Name: 1-(2-chloroethyl)-4-methylbenzene
SYSTEMATIC NAME: 1-(2-chloroethyl)-4-methyl-benzene
MOLECULAR FORMULA: C9H11Cl
MOLECULAR WEIGHT: 154.63664
SMILES: CC1=CC=C(C=C1)CCCl
Structure:
CAS RN: 39562-66-8
CAS Name: 1-(2-chloroethyl)-2-methylbenzene
OPENEYE Name: 1-(2-chloroethyl)-2-methyl-benzene
IUPAC Name: 1-(2-chloroethyl)-2-methylbenzene
SYSTEMATIC NAME: 1-(2-chloroethyl)-2-methyl-benzene
MOLECULAR FORMULA: C9H11Cl
MOLECULAR WEIGHT: 154.63664
SMILES: CC1=CC=CC=C1CCCl
Structure:
CAS RN: 1914-39-2
CAS Name: 1-(2-chloroethylamino)-4-methyl-9-thioxanthenone
OPENEYE Name: 1-(2-chloroethylamino)-4-methyl-thioxanthen-9-one
IUPAC Name: 1-(2-chloroethylamino)-4-methylthioxanthen-9-one
SYSTEMATIC NAME: 1-(2-chloroethylamino)-4-methyl-thioxanthen-9-one
MOLECULAR FORMULA: C16H14ClNOS
MOLECULAR WEIGHT: 303.80646
SMILES: CC1=C2C(=C(C=C1)NCCCl)C(=O)C3=CC=CC=C3S2
Structure:
CAS RN: 96450-92-9
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C10H14N2O6
MOLECULAR WEIGHT: 258.22796
SMILES: CN1C2C(C3C(C(C2OC1=O)O)OC(=O)N3C)O
Structure:
CAS RN: 91270-28-9
CAS Name: 1-(3,5-dichloro-2-hydroxy-6-methylphenyl)ethanone
OPENEYE Name: 1-(3,5-dichloro-2-hydroxy-6-methyl-phenyl)ethanone
IUPAC Name: 1-(3,5-dichloro-2-hydroxy-6-methylphenyl)ethanone
SYSTEMATIC NAME: 1-[3,5-bis(chloranyl)-2-methyl-6-oxidanyl-phenyl]ethanone
MOLECULAR FORMULA: C9H8Cl2O2
MOLECULAR WEIGHT: 219.06462
SMILES: CC1=C(C(=C(C=C1Cl)Cl)O)C(=O)C
Structure:
CAS RN: 609-69-8
CAS Name: 2-hydroxy-1-cyclohexanecarboxylic acid
OPENEYE Name: 2-hydroxycyclohexanecarboxylic acid
IUPAC Name: 2-hydroxycyclohexane-1-carboxylic acid
SYSTEMATIC NAME: 2-oxidanylcyclohexane-1-carboxylic acid
MOLECULAR FORMULA: C7H12O3
MOLECULAR WEIGHT: 144.16838
SMILES: C1CCC(C(C1)C(=O)O)O
Structure:
CAS RN: 17502-32-8
CAS Name: 2-hydroxy-1-cyclohexanecarboxylic acid
OPENEYE Name: 2-hydroxycyclohexanecarboxylic acid
IUPAC Name: 2-hydroxycyclohexane-1-carboxylic acid
SYSTEMATIC NAME: 2-oxidanylcyclohexane-1-carboxylic acid
MOLECULAR FORMULA: C7H12O3
MOLECULAR WEIGHT: 144.16838
SMILES: C1CCC(C(C1)C(=O)O)O
Structure:
CAS RN: 28131-61-5
CAS Name: 2-hydroxy-1-cyclohexanecarboxylic acid
OPENEYE Name: 2-hydroxycyclohexanecarboxylic acid
IUPAC Name: 2-hydroxycyclohexane-1-carboxylic acid
SYSTEMATIC NAME: 2-oxidanylcyclohexane-1-carboxylic acid
MOLECULAR FORMULA: C7H12O3
MOLECULAR WEIGHT: 144.16838
SMILES: C1CCC(C(C1)C(=O)O)O
Structure:
CAS RN: 16759-13-0
CAS Name: 1-chloro-2-[1-(2-chlorophenyl)-2-iodoethyl]benzene
OPENEYE Name: 1-chloro-2-[1-(2-chlorophenyl)-2-iodo-ethyl]benzene
IUPAC Name: 1-chloro-2-[1-(2-chlorophenyl)-2-iodoethyl]benzene
SYSTEMATIC NAME: 1-chloranyl-2-[1-(2-chlorophenyl)-2-iodanyl-ethyl]benzene
MOLECULAR FORMULA: C14H11Cl2I
MOLECULAR WEIGHT: 377.04761
SMILES: C1=CC=C(C(=C1)C(CI)C2=CC=CC=C2Cl)Cl
Structure:
CAS RN: 52617-98-8
CAS Name: 10-chloro-6-methoxy-1,4a-dimethyl-9-oxo-3,4,10,10a-tetrahydro-2H-phenanthrene-1-carboxylic acid methyl ester
OPENEYE Name: methyl 10-chloro-6-methoxy-1,4a-dimethyl-9-oxo-3,4,10,10a-tetrahydro-2H-phenanthrene-1-carboxylate
IUPAC Name: methyl 10-chloro-6-methoxy-1,4a-dimethyl-9-oxo-3,4,10,10a-tetrahydro-2H-phenanthrene-1-carboxylate
SYSTEMATIC NAME: methyl 10-chloranyl-6-methoxy-1,4a-dimethyl-9-oxidanylidene-3,4,10,10a-tetrahydro-2H-phenanthrene-1-carboxylate
MOLECULAR FORMULA: C19H23ClO4
MOLECULAR WEIGHT: 350.83652
SMILES: CC12CCCC(C1C(C(=O)C3=C2C=C(C=C3)OC)Cl)(C)C(=O)OC
Structure:
CAS RN: 1231-74-9
CAS Name: 6-methoxy-1,4a-dimethyl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylic acid methyl ester
OPENEYE Name: methyl 6-methoxy-1,4a-dimethyl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylate
IUPAC Name: methyl 6-methoxy-1,4a-dimethyl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylate
SYSTEMATIC NAME: methyl 6-methoxy-1,4a-dimethyl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylate
MOLECULAR FORMULA: C19H26O3
MOLECULAR WEIGHT: 302.40794
SMILES: CC12CCCC(C1CCC3=C2C=C(C=C3)OC)(C)C(=O)OC
Structure:
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