4-[2-(2-oxidanylidenepropyl)-1,2,3,4-tetrazol-5-yl]-4-phenyl-piperidine-1-carboxylic acid

Systemtic Name: 4-[2-(2-oxidanylidenepropyl)-1,2,3,4-tetrazol-5-yl]-4-phenyl-piperidine-1-carboxylic acid Openeye Name: 4-(2-acetonyltetrazol-5-yl)-4-phenyl-piperidine-1-carboxylic acid CAS Name: 4-[2-(2-oxopropyl)-5-tetrazolyl]-4-phenyl-1-piperidinecarboxylic acid IUPAC Name: 4-[2-(2-oxopropyl)tetrazol-5-yl]-4-phenylpiperidine-1-carboxylic acid Traditional Name: 4-(2-acetonyltetrazol-5-yl)-4-phenyl-piperidine-1-carboxylic acid Formula: C16H19N5O3 MolecularWeight: 329.35376

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CN1N=C(N=N1)C2(CCN(CC2)C(=O)O)C3=CC=CC=C3

Isomeric SMILES

CC(=O)CN1N=C(N=N1)C2(CCN(CC2)C(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C16H19N5O3/c1-12(22)11-21-18-14(17-19-21)16(13-5-3-2-4-6-13)7-9-20(10-8-16)15(23)24/h2-6H,7-11H2,1H3,(H,23,24)