2-[(3-cyanophenyl)carbonylamino]-3-(3-methoxypropyl)benzimidazole-4-carboxylic acid

Systemtic Name: 2-[(3-cyanophenyl)carbonylamino]-3-(3-methoxypropyl)benzimidazole-4-carboxylic acid Openeye Name: 2-[(3-cyanobenzoyl)amino]-3-(3-methoxypropyl)benzimidazole-4-carboxylic acid CAS Name: 2-[[(3-cyanophenyl)-oxomethyl]amino]-3-(3-methoxypropyl)-4-benzimidazolecarboxylic acid IUPAC Name: 2-[(3-cyanobenzoyl)amino]-3-(3-methoxypropyl)benzimidazole-4-carboxylic acid Traditional Name: 2-[(3-cyanobenzoyl)amino]-3-(3-methoxypropyl)benzimidazole-4-carboxylic acid Formula: C20H18N4O4 MolecularWeight: 378.38132

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN1C2=C(C=CC=C2N=C1NC(=O)C3=CC=CC(=C3)C#N)C(=O)O

Isomeric SMILES

COCCCN1C2=C(C=CC=C2N=C1NC(=O)C3=CC=CC(=C3)C#N)C(=O)O

InChI

InChI=1S/C20H18N4O4/c1-28-10-4-9-24-17-15(19(26)27)7-3-8-16(17)22-20(24)23-18(25)14-6-2-5-13(11-14)12-21/h2-3,5-8,11H,4,9-10H2,1H3,(H,26,27)(H,22,23,25)