1-(4-methyl-3-nitro-phenyl)-2-(5-phenyl-1,2,3,4-tetrazol-2-yl)ethanone

Systemtic Name: 1-(4-methyl-3-nitro-phenyl)-2-(5-phenyl-1,2,3,4-tetrazol-2-yl)ethanone Openeye Name: 1-(4-methyl-3-nitro-phenyl)-2-(5-phenyltetrazol-2-yl)ethanone CAS Name: 1-(4-methyl-3-nitrophenyl)-2-(5-phenyl-2-tetrazolyl)ethanone IUPAC Name: 1-(4-methyl-3-nitrophenyl)-2-(5-phenyltetrazol-2-yl)ethanone Traditional Name: 1-(4-methyl-3-nitro-phenyl)-2-(5-phenyltetrazol-2-yl)ethanone Formula: C16H13N5O3 MolecularWeight: 323.30612

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)CN2N=C(N=N2)C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)CN2N=C(N=N2)C3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H13N5O3/c1-11-7-8-13(9-14(11)21(23)24)15(22)10-20-18-16(17-19-20)12-5-3-2-4-6-12/h2-9H,10H2,1H3