[1-(4-methylpiperidin-1-yl)-1-oxidanylidene-propan-2-yl] 4-(1,2,3,4-tetrazol-1-yl)benzoate

Systemtic Name: [1-(4-methylpiperidin-1-yl)-1-oxidanylidene-propan-2-yl] 4-(1,2,3,4-tetrazol-1-yl)benzoate Openeye Name: [1-methyl-2-(4-methyl-1-piperidyl)-2-oxo-ethyl] 4-(tetrazol-1-yl)benzoate CAS Name: 4-(1-tetrazolyl)benzoic acid [1-(4-methyl-1-piperidinyl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(4-methylpiperidin-1-yl)-1-oxopropan-2-yl] 4-(tetrazol-1-yl)benzoate Traditional Name: 4-(tetrazol-1-yl)benzoic acid [2-keto-1-methyl-2-(4-methylpiperidino)ethyl] ester Formula: C17H21N5O3 MolecularWeight: 343.38034

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)C(C)OC(=O)C2=CC=C(C=C2)N3C=NN=N3

Isomeric SMILES

CC1CCN(CC1)C(=O)C(C)OC(=O)C2=CC=C(C=C2)N3C=NN=N3

InChI

InChI=1S/C17H21N5O3/c1-12-7-9-21(10-8-12)16(23)13(2)25-17(24)14-3-5-15(6-4-14)22-11-18-19-20-22/h3-6,11-13H,7-10H2,1-2H3