1-cyclohexyl-2-[2-[3-(2-methoxyethoxy)phenyl]quinolin-6-yl]benzimidazole-5-carboxylic acid

Systemtic Name: 1-cyclohexyl-2-[2-[3-(2-methoxyethoxy)phenyl]quinolin-6-yl]benzimidazole-5-carboxylic acid Openeye Name: 1-cyclohexyl-2-[2-[3-(2-methoxyethoxy)phenyl]-6-quinolyl]benzimidazole-5-carboxylic acid CAS Name: 1-cyclohexyl-2-[2-[3-(2-methoxyethoxy)phenyl]-6-quinolinyl]-5-benzimidazolecarboxylic acid IUPAC Name: 1-cyclohexyl-2-[2-[3-(2-methoxyethoxy)phenyl]quinolin-6-yl]benzimidazole-5-carboxylic acid Traditional Name: 1-cyclohexyl-2-[2-[3-(2-methoxyethoxy)phenyl]-6-quinolyl]benzimidazole-5-carboxylic acid Formula: C32H31N3O4 MolecularWeight: 521.60624

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC1=CC=CC(=C1)C2=NC3=C(C=C2)C=C(C=C3)C4=NC5=C(N4C6CCCCC6)C=CC(=C5)C(=O)O

Isomeric SMILES

COCCOC1=CC=CC(=C1)C2=NC3=C(C=C2)C=C(C=C3)C4=NC5=C(N4C6CCCCC6)C=CC(=C5)C(=O)O

InChI

InChI=1S/C32H31N3O4/c1-38-16-17-39-26-9-5-6-21(19-26)27-13-10-22-18-23(11-14-28(22)33-27)31-34-29-20-24(32(36)37)12-15-30(29)35(31)25-7-3-2-4-8-25/h5-6,9-15,18-20,25H,2-4,7-8,16-17H2,1H3,(H,36,37)