ethyl 1-[3-(1,2,3,4-tetrazol-1-yl)phenyl]carbonylpiperidine-3-carboxylate

Systemtic Name: ethyl 1-[3-(1,2,3,4-tetrazol-1-yl)phenyl]carbonylpiperidine-3-carboxylate Openeye Name: ethyl 1-[3-(tetrazol-1-yl)benzoyl]piperidine-3-carboxylate CAS Name: 1-[oxo-[3-(1-tetrazolyl)phenyl]methyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-(tetrazol-1-yl)benzoyl]piperidine-3-carboxylate Traditional Name: 1-[3-(tetrazol-1-yl)benzoyl]nipecotic acid ethyl ester Formula: C16H19N5O3 MolecularWeight: 329.35376

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)C2=CC(=CC=C2)N3C=NN=N3

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)C2=CC(=CC=C2)N3C=NN=N3

InChI

InChI=1S/C16H19N5O3/c1-2-24-16(23)13-6-4-8-20(10-13)15(22)12-5-3-7-14(9-12)21-11-17-18-19-21/h3,5,7,9,11,13H,2,4,6,8,10H2,1H3