cyclohexyl 1-chloranyl-4-(4-chlorophenyl)-2-(2-nitrophenyl)sulfanyl-2,3,3a,4,5,9b-hexahydro-1H-cyclopenta[c]quinoline-8-carboxylate

Systemtic Name: cyclohexyl 1-chloranyl-4-(4-chlorophenyl)-2-(2-nitrophenyl)sulfanyl-2,3,3a,4,5,9b-hexahydro-1H-cyclopenta[c]quinoline-8-carboxylate Openeye Name: cyclohexyl 1-chloro-4-(4-chlorophenyl)-2-(2-nitrophenyl)sulfanyl-2,3,3a,4,5,9b-hexahydro-1H-cyclopenta[c]quinoline-8-carboxylate CAS Name: 1-chloro-4-(4-chlorophenyl)-2-[(2-nitrophenyl)thio]-2,3,3a,4,5,9b-hexahydro-1H-cyclopenta[c]quinoline-8-carboxylic acid cyclohexyl ester IUPAC Name: cyclohexyl 1-chloro-4-(4-chlorophenyl)-2-(2-nitrophenyl)sulfanyl-2,3,3a,4,5,9b-hexahydro-1H-cyclopenta[c]quinoline-8-carboxylate Traditional Name: 1-chloro-4-(4-chlorophenyl)-2-[(2-nitrophenyl)thio]-2,3,3a,4,5,9b-hexahydro-1H-cyclopenta[c]quinoline-8-carboxylic acid cyclohexyl ester Formula: C31H30Cl2N2O4S MolecularWeight: 597.5519

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)OC(=O)C2=CC3=C(C=C2)NC(C4C3C(C(C4)SC5=CC=CC=C5[N+](=O)[O-])Cl)C6=CC=C(C=C6)Cl

Isomeric SMILES

C1CCC(CC1)OC(=O)C2=CC3=C(C=C2)NC(C4C3C(C(C4)SC5=CC=CC=C5[N+](=O)[O-])Cl)C6=CC=C(C=C6)Cl

InChI

InChI=1S/C31H30Cl2N2O4S/c32-20-13-10-18(11-14-20)30-23-17-27(40-26-9-5-4-8-25(26)35(37)38)29(33)28(23)22-16-19(12-15-24(22)34-30)31(36)39-21-6-2-1-3-7-21/h4-5,8-16,21,23,27-30,34H,1-3,6-7,17H2