N-[[2-(2-oxidanylidenepropyl)-1,2,3,4-tetrazol-5-yl]methyl]-4-phenyl-benzamide

Systemtic Name: N-[[2-(2-oxidanylidenepropyl)-1,2,3,4-tetrazol-5-yl]methyl]-4-phenyl-benzamide Openeye Name: N-[(2-acetonyltetrazol-5-yl)methyl]-4-phenyl-benzamide CAS Name: N-[[2-(2-oxopropyl)-5-tetrazolyl]methyl]-4-phenylbenzamide IUPAC Name: N-[[2-(2-oxopropyl)tetrazol-5-yl]methyl]-4-phenylbenzamide Traditional Name: N-[(2-acetonyltetrazol-5-yl)methyl]-4-phenyl-benzamide Formula: C18H17N5O2 MolecularWeight: 335.35988

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CN1N=C(N=N1)CNC(=O)C2=CC=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

CC(=O)CN1N=C(N=N1)CNC(=O)C2=CC=C(C=C2)C3=CC=CC=C3

InChI

InChI=1S/C18H17N5O2/c1-13(24)12-23-21-17(20-22-23)11-19-18(25)16-9-7-15(8-10-16)14-5-3-2-4-6-14/h2-10H,11-12H2,1H3,(H,19,25)