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

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

Systemtic Name:1-chloranyl-4-(2,4-dichlorophenyl)-2-(2-nitrophenyl)sulfanyl-2,3,3a,4,5,9b-hexahydro-1H-cyclopenta[c]quinoline-8-carboxylic acid
Openeye Name:1-chloro-4-(2,4-dichlorophenyl)-2-(2-nitrophenyl)sulfanyl-2,3,3a,4,5,9b-hexahydro-1H-cyclopenta[c]quinoline-8-carboxylic acid
CAS Name:1-chloro-4-(2,4-dichlorophenyl)-2-[(2-nitrophenyl)thio]-2,3,3a,4,5,9b-hexahydro-1H-cyclopenta[c]quinoline-8-carboxylic acid
IUPAC Name:1-chloro-4-(2,4-dichlorophenyl)-2-(2-nitrophenyl)sulfanyl-2,3,3a,4,5,9b-hexahydro-1H-cyclopenta[c]quinoline-8-carboxylic acid
Traditional Name:1-chloro-4-(2,4-dichlorophenyl)-2-[(2-nitrophenyl)thio]-2,3,3a,4,5,9b-hexahydro-1H-cyclopenta[c]quinoline-8-carboxylic acid
Formula: C25H19Cl3N2O4S
MolecularWeight: 549.85336
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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=C(C=C(C=C5)Cl)Cl


Isomeric SMILES

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


InChI

InChI=1S/C25H19Cl3N2O4S/c26-13-6-7-14(17(27)10-13)24-16-11-21(35-20-4-2-1-3-19(20)30(33)34)23(28)22(16)15-9-12(25(31)32)5-8-18(15)29-24/h1-10,16,21-24,29H,11H2,(H,31,32)


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