2-[2-[2-(4-chlorophenyl)-5-methoxy-phenyl]quinolin-6-yl]-1-cyclopropyl-benzimidazole-5-carboxylic acid

Systemtic Name: 2-[2-[2-(4-chlorophenyl)-5-methoxy-phenyl]quinolin-6-yl]-1-cyclopropyl-benzimidazole-5-carboxylic acid Openeye Name: 2-[2-[2-(4-chlorophenyl)-5-methoxy-phenyl]-6-quinolyl]-1-cyclopropyl-benzimidazole-5-carboxylic acid CAS Name: 2-[2-[2-(4-chlorophenyl)-5-methoxyphenyl]-6-quinolinyl]-1-cyclopropyl-5-benzimidazolecarboxylic acid IUPAC Name: 2-[2-[2-(4-chlorophenyl)-5-methoxyphenyl]quinolin-6-yl]-1-cyclopropylbenzimidazole-5-carboxylic acid Traditional Name: 2-[2-[2-(4-chlorophenyl)-5-methoxy-phenyl]-6-quinolyl]-1-cyclopropyl-benzimidazole-5-carboxylic acid Formula: C33H24ClN3O3 MolecularWeight: 546.01496

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C2=CC=C(C=C2)Cl)C3=NC4=C(C=C3)C=C(C=C4)C5=NC6=C(N5C7CC7)C=CC(=C6)C(=O)O

Isomeric SMILES

COC1=CC(=C(C=C1)C2=CC=C(C=C2)Cl)C3=NC4=C(C=C3)C=C(C=C4)C5=NC6=C(N5C7CC7)C=CC(=C6)C(=O)O

InChI

InChI=1S/C33H24ClN3O3/c1-40-25-11-12-26(19-2-7-23(34)8-3-19)27(18-25)29-14-4-20-16-21(5-13-28(20)35-29)32-36-30-17-22(33(38)39)6-15-31(30)37(32)24-9-10-24/h2-8,11-18,24H,9-10H2,1H3,(H,38,39)