2-[4-(piperidin-4-ylmethyl)phenyl]-3H-benzimidazole-5-carboxylic acid

Systemtic Name: 2-[4-(piperidin-4-ylmethyl)phenyl]-3H-benzimidazole-5-carboxylic acid Openeye Name: 2-[4-(4-piperidylmethyl)phenyl]-3H-benzimidazole-5-carboxylic acid CAS Name: 2-[4-(4-piperidinylmethyl)phenyl]-3H-benzimidazole-5-carboxylic acid IUPAC Name: 2-[4-(piperidin-4-ylmethyl)phenyl]-3H-benzimidazole-5-carboxylic acid Traditional Name: 2-[4-(4-piperidylmethyl)phenyl]-3H-benzimidazole-5-carboxylic acid Formula: C20H21N3O2 MolecularWeight: 335.39964

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1CC2=CC=C(C=C2)C3=NC4=C(N3)C=C(C=C4)C(=O)O

Isomeric SMILES

C1CNCCC1CC2=CC=C(C=C2)C3=NC4=C(N3)C=C(C=C4)C(=O)O

InChI

InChI=1S/C20H21N3O2/c24-20(25)16-5-6-17-18(12-16)23-19(22-17)15-3-1-13(2-4-15)11-14-7-9-21-10-8-14/h1-6,12,14,21H,7-11H2,(H,22,23)(H,24,25)