ethyl 4-phenethyl-1-[3-(1,2,3,4-tetrazol-1-yl)propanoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 4-phenethyl-1-[3-(1,2,3,4-tetrazol-1-yl)propanoyl]piperidine-4-carboxylate Openeye Name: ethyl 4-phenethyl-1-[3-(tetrazol-1-yl)propanoyl]piperidine-4-carboxylate CAS Name: 1-[1-oxo-3-(1-tetrazolyl)propyl]-4-phenethyl-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-phenethyl-1-[3-(tetrazol-1-yl)propanoyl]piperidine-4-carboxylate Traditional Name: 4-phenethyl-1-[3-(tetrazol-1-yl)propanoyl]isonipecotic acid ethyl ester Formula: C20H27N5O3 MolecularWeight: 385.46008

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCN(CC1)C(=O)CCN2C=NN=N2)CCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1(CCN(CC1)C(=O)CCN2C=NN=N2)CCC3=CC=CC=C3

InChI

InChI=1S/C20H27N5O3/c1-2-28-19(27)20(10-8-17-6-4-3-5-7-17)11-14-24(15-12-20)18(26)9-13-25-16-21-22-23-25/h3-7,16H,2,8-15H2,1H3