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

Systemtic Name: 1-chloranyl-4-(4-nitrophenyl)-2-(2-nitrophenyl)sulfanyl-2,3,3a,4,5,9b-hexahydro-1H-cyclopenta[c]quinoline-8-carboxylic acid Openeye Name: 1-chloro-4-(4-nitrophenyl)-2-(2-nitrophenyl)sulfanyl-2,3,3a,4,5,9b-hexahydro-1H-cyclopenta[c]quinoline-8-carboxylic acid CAS Name: 1-chloro-4-(4-nitrophenyl)-2-[(2-nitrophenyl)thio]-2,3,3a,4,5,9b-hexahydro-1H-cyclopenta[c]quinoline-8-carboxylic acid IUPAC Name: 1-chloro-4-(4-nitrophenyl)-2-(2-nitrophenyl)sulfanyl-2,3,3a,4,5,9b-hexahydro-1H-cyclopenta[c]quinoline-8-carboxylic acid Traditional Name: 1-chloro-4-(4-nitrophenyl)-2-[(2-nitrophenyl)thio]-2,3,3a,4,5,9b-hexahydro-1H-cyclopenta[c]quinoline-8-carboxylic acid Formula: C25H20ClN3O6S MolecularWeight: 525.9608

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Descriptors Computed from Structure

Canonical SMILES:

C1C2C(C(C1SC3=CC=CC=C3[N+](=O)[O-])Cl)C4=C(C=CC(=C4)C(=O)O)NC2C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1C2C(C(C1SC3=CC=CC=C3[N+](=O)[O-])Cl)C4=C(C=CC(=C4)C(=O)O)NC2C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C25H20ClN3O6S/c26-23-21(36-20-4-2-1-3-19(20)29(34)35)12-17-22(23)16-11-14(25(30)31)7-10-18(16)27-24(17)13-5-8-15(9-6-13)28(32)33/h1-11,17,21-24,27H,12H2,(H,30,31)