ethyl 4-[(6-chloranyl-1H-benzimidazol-2-yl)-(phenylmethyl)amino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[(6-chloranyl-1H-benzimidazol-2-yl)-(phenylmethyl)amino]piperidine-1-carboxylate Openeye Name: ethyl 4-[benzyl-(6-chloro-1H-benzimidazol-2-yl)amino]piperidine-1-carboxylate CAS Name: 4-[(6-chloro-1H-benzimidazol-2-yl)-(phenylmethyl)amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[benzyl-(6-chloro-1H-benzimidazol-2-yl)amino]piperidine-1-carboxylate Traditional Name: 4-[benzyl-(6-chloro-1H-benzimidazol-2-yl)amino]piperidine-1-carboxylic acid ethyl ester Formula: C22H25ClN4O2 MolecularWeight: 412.9125

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)N(CC2=CC=CC=C2)C3=NC4=C(N3)C=C(C=C4)Cl

Isomeric SMILES

CCOC(=O)N1CCC(CC1)N(CC2=CC=CC=C2)C3=NC4=C(N3)C=C(C=C4)Cl

InChI

InChI=1S/C22H25ClN4O2/c1-2-29-22(28)26-12-10-18(11-13-26)27(15-16-6-4-3-5-7-16)21-24-19-9-8-17(23)14-20(19)25-21/h3-9,14,18H,2,10-13,15H2,1H3,(H,24,25)