2-[1-(4-chlorophenyl)cyclopropyl]-3-oxidanyl-8-thiophen-3-yl-quinoline-4-carboxylic acid

Systemtic Name: 2-[1-(4-chlorophenyl)cyclopropyl]-3-oxidanyl-8-thiophen-3-yl-quinoline-4-carboxylic acid Openeye Name: 2-[1-(4-chlorophenyl)cyclopropyl]-3-hydroxy-8-(3-thienyl)quinoline-4-carboxylic acid CAS Name: 2-[1-(4-chlorophenyl)cyclopropyl]-3-hydroxy-8-(3-thiophenyl)-4-quinolinecarboxylic acid IUPAC Name: 2-[1-(4-chlorophenyl)cyclopropyl]-3-hydroxy-8-thiophen-3-ylquinoline-4-carboxylic acid Traditional Name: 2-[1-(4-chlorophenyl)cyclopropyl]-3-hydroxy-8-(3-thienyl)cinchoninic acid Formula: C23H16ClNO3S MolecularWeight: 421.89604

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1(C2=CC=C(C=C2)Cl)C3=C(C(=C4C=CC=C(C4=N3)C5=CSC=C5)C(=O)O)O

Isomeric SMILES

C1CC1(C2=CC=C(C=C2)Cl)C3=C(C(=C4C=CC=C(C4=N3)C5=CSC=C5)C(=O)O)O

InChI

InChI=1S/C23H16ClNO3S/c24-15-6-4-14(5-7-15)23(9-10-23)21-20(26)18(22(27)28)17-3-1-2-16(19(17)25-21)13-8-11-29-12-13/h1-8,11-12,26H,9-10H2,(H,27,28)