[2-[(4-nitrophenyl)amino]-2-oxidanylidene-ethyl] 2-(5-phenyl-1,2,3,4-tetrazol-2-yl)ethanoate

Systemtic Name: [2-[(4-nitrophenyl)amino]-2-oxidanylidene-ethyl] 2-(5-phenyl-1,2,3,4-tetrazol-2-yl)ethanoate Openeye Name: [2-(4-nitroanilino)-2-oxo-ethyl] 2-(5-phenyltetrazol-2-yl)acetate CAS Name: 2-(5-phenyl-2-tetrazolyl)acetic acid [2-(4-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-nitroanilino)-2-oxoethyl] 2-(5-phenyltetrazol-2-yl)acetate Traditional Name: 2-(5-phenyltetrazol-2-yl)acetic acid [2-keto-2-(4-nitroanilino)ethyl] ester Formula: C17H14N6O5 MolecularWeight: 382.33026

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(N=N2)CC(=O)OCC(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(N=N2)CC(=O)OCC(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H14N6O5/c24-15(18-13-6-8-14(9-7-13)23(26)27)11-28-16(25)10-22-20-17(19-21-22)12-4-2-1-3-5-12/h1-9H,10-11H2,(H,18,24)