4-[3-(benzimidazol-1-yl)propylamino]-1-phenyl-cyclohexane-1-carbonitrile; ethanedioic acid

Systemtic Name: 4-[3-(benzimidazol-1-yl)propylamino]-1-phenyl-cyclohexane-1-carbonitrile; ethanedioic acid Openeye Name: 4-[3-(benzimidazol-1-yl)propylamino]-1-phenyl-cyclohexanecarbonitrile; oxalic acid CAS Name: 4-[3-(1-benzimidazolyl)propylamino]-1-phenyl-1-cyclohexanecarbonitrile; oxalic acid IUPAC Name: 4-[3-(benzimidazol-1-yl)propylamino]-1-phenylcyclohexane-1-carbonitrile; oxalic acid Traditional Name: 4-[3-(benzimidazol-1-yl)propylamino]-1-phenyl-cyclohexanecarbonitrile; oxalic acid Formula: C25H28N4O4 MolecularWeight: 448.51422

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1NCCCN2C=NC3=CC=CC=C32)(C#N)C4=CC=CC=C4.C(=O)(C(=O)O)O

Isomeric SMILES

C1CC(CCC1NCCCN2C=NC3=CC=CC=C32)(C#N)C4=CC=CC=C4.C(=O)(C(=O)O)O

InChI

InChI=1S/C23H26N4.C2H2O4/c24-17-23(19-7-2-1-3-8-19)13-11-20(12-14-23)25-15-6-16-27-18-26-21-9-4-5-10-22(21)27;3-1(4)2(5)6/h1-5,7-10,18,20,25H,6,11-16H2;(H,3,4)(H,5,6)