1-azanyl-2-(2-naphthalen-1-yl-1-piperidin-4-yl-ethyl)benzimidazole-5-carboxylic acid

Systemtic Name: 1-azanyl-2-(2-naphthalen-1-yl-1-piperidin-4-yl-ethyl)benzimidazole-5-carboxylic acid Openeye Name: 1-amino-2-[2-(1-naphthyl)-1-(4-piperidyl)ethyl]benzimidazole-5-carboxylic acid CAS Name: 1-amino-2-[2-(1-naphthalenyl)-1-(4-piperidinyl)ethyl]-5-benzimidazolecarboxylic acid IUPAC Name: 1-amino-2-(2-naphthalen-1-yl-1-piperidin-4-ylethyl)benzimidazole-5-carboxylic acid Traditional Name: 1-amino-2-[2-(1-naphthyl)-1-(4-piperidyl)ethyl]benzimidazole-5-carboxylic acid Formula: C25H26N4O2 MolecularWeight: 414.49954

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1C(CC2=CC=CC3=CC=CC=C32)C4=NC5=C(N4N)C=CC(=C5)C(=O)O

Isomeric SMILES

C1CNCCC1C(CC2=CC=CC3=CC=CC=C32)C4=NC5=C(N4N)C=CC(=C5)C(=O)O

InChI

InChI=1S/C25H26N4O2/c26-29-23-9-8-19(25(30)31)15-22(23)28-24(29)21(17-10-12-27-13-11-17)14-18-6-3-5-16-4-1-2-7-20(16)18/h1-9,15,17,21,27H,10-14,26H2,(H,30,31)