1-cyclohexyl-2-[2-(4-morpholin-4-ylphenyl)quinolin-6-yl]benzimidazole-5-carboxylic acid

Systemtic Name: 1-cyclohexyl-2-[2-(4-morpholin-4-ylphenyl)quinolin-6-yl]benzimidazole-5-carboxylic acid Openeye Name: 1-cyclohexyl-2-[2-(4-morpholinophenyl)-6-quinolyl]benzimidazole-5-carboxylic acid CAS Name: 1-cyclohexyl-2-[2-[4-(4-morpholinyl)phenyl]-6-quinolinyl]-5-benzimidazolecarboxylic acid IUPAC Name: 1-cyclohexyl-2-[2-(4-morpholin-4-ylphenyl)quinolin-6-yl]benzimidazole-5-carboxylic acid Traditional Name: 1-cyclohexyl-2-[2-(4-morpholinophenyl)-6-quinolyl]benzimidazole-5-carboxylic acid Formula: C33H32N4O3 MolecularWeight: 532.63218

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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=C5)C6=CC=C(C=C6)N7CCOCC7

Isomeric SMILES

C1CCC(CC1)N2C3=C(C=C(C=C3)C(=O)O)N=C2C4=CC5=C(C=C4)N=C(C=C5)C6=CC=C(C=C6)N7CCOCC7

InChI

InChI=1S/C33H32N4O3/c38-33(39)25-10-15-31-30(21-25)35-32(37(31)27-4-2-1-3-5-27)24-9-14-29-23(20-24)8-13-28(34-29)22-6-11-26(12-7-22)36-16-18-40-19-17-36/h6-15,20-21,27H,1-5,16-19H2,(H,38,39)