1-cyclohexyl-2-[4-[(3-ethoxy-3-oxidanylidene-propyl)-(phenylmethyl)carbamoyl]phenyl]benzimidazole-5-carboxylic acid

Systemtic Name: 1-cyclohexyl-2-[4-[(3-ethoxy-3-oxidanylidene-propyl)-(phenylmethyl)carbamoyl]phenyl]benzimidazole-5-carboxylic acid Openeye Name: 2-[4-[benzyl-(3-ethoxy-3-oxo-propyl)carbamoyl]phenyl]-1-cyclohexyl-benzimidazole-5-carboxylic acid CAS Name: 1-cyclohexyl-2-[4-[[(3-ethoxy-3-oxopropyl)-(phenylmethyl)amino]-oxomethyl]phenyl]-5-benzimidazolecarboxylic acid IUPAC Name: 2-[4-[benzyl-(3-ethoxy-3-oxopropyl)carbamoyl]phenyl]-1-cyclohexylbenzimidazole-5-carboxylic acid Traditional Name: 2-[4-[benzyl-(3-ethoxy-3-keto-propyl)carbamoyl]phenyl]-1-cyclohexyl-benzimidazole-5-carboxylic acid Formula: C33H35N3O5 MolecularWeight: 553.6481

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCN(CC1=CC=CC=C1)C(=O)C2=CC=C(C=C2)C3=NC4=C(N3C5CCCCC5)C=CC(=C4)C(=O)O

Isomeric SMILES

CCOC(=O)CCN(CC1=CC=CC=C1)C(=O)C2=CC=C(C=C2)C3=NC4=C(N3C5CCCCC5)C=CC(=C4)C(=O)O

InChI

InChI=1S/C33H35N3O5/c1-2-41-30(37)19-20-35(22-23-9-5-3-6-10-23)32(38)25-15-13-24(14-16-25)31-34-28-21-26(33(39)40)17-18-29(28)36(31)27-11-7-4-8-12-27/h3,5-6,9-10,13-18,21,27H,2,4,7-8,11-12,19-20,22H2,1H3,(H,39,40)