1-cyclohexyl-2-[4-(7-oxidanylnaphthalen-2-yl)oxy-2-phenyl-quinolin-6-yl]benzimidazole-5-carboxylic acid

Systemtic Name: 1-cyclohexyl-2-[4-(7-oxidanylnaphthalen-2-yl)oxy-2-phenyl-quinolin-6-yl]benzimidazole-5-carboxylic acid Openeye Name: 1-cyclohexyl-2-[4-[(7-hydroxy-2-naphthyl)oxy]-2-phenyl-6-quinolyl]benzimidazole-5-carboxylic acid CAS Name: 1-cyclohexyl-2-[4-[(7-hydroxy-2-naphthalenyl)oxy]-2-phenyl-6-quinolinyl]-5-benzimidazolecarboxylic acid IUPAC Name: 1-cyclohexyl-2-[4-(7-hydroxynaphthalen-2-yl)oxy-2-phenylquinolin-6-yl]benzimidazole-5-carboxylic acid Traditional Name: 1-cyclohexyl-2-[4-(7-hydroxy-2-naphthoxy)-2-phenyl-6-quinolyl]benzimidazole-5-carboxylic acid Formula: C39H31N3O4 MolecularWeight: 605.68114

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C3=C(C=C(C=C3)C(=O)O)N=C2C4=CC5=C(C=C4)N=C(C=C5OC6=CC7=C(C=CC(=C7)O)C=C6)C8=CC=CC=C8

Isomeric SMILES

C1CCC(CC1)N2C3=C(C=C(C=C3)C(=O)O)N=C2C4=CC5=C(C=C4)N=C(C=C5OC6=CC7=C(C=CC(=C7)O)C=C6)C8=CC=CC=C8

InChI

InChI=1S/C39H31N3O4/c43-30-15-11-24-12-16-31(20-28(24)19-30)46-37-23-34(25-7-3-1-4-8-25)40-33-17-13-26(21-32(33)37)38-41-35-22-27(39(44)45)14-18-36(35)42(38)29-9-5-2-6-10-29/h1,3-4,7-8,11-23,29,43H,2,5-6,9-10H2,(H,44,45)