[(E)-N-[4-(4-nitrophenyl)-1,2,3-triazol-1-yl]-C-phenyl-carbonimidoyl] benzoate

Systemtic Name: [(E)-N-[4-(4-nitrophenyl)-1,2,3-triazol-1-yl]-C-phenyl-carbonimidoyl] benzoate Openeye Name: [(E)-N-[4-(4-nitrophenyl)triazol-1-yl]-C-phenyl-carbonimidoyl] benzoate CAS Name: benzoic acid [(E)-[4-(4-nitrophenyl)-1-triazolyl]imino-phenylmethyl] ester IUPAC Name: [(E)-N-[4-(4-nitrophenyl)triazol-1-yl]-C-phenylcarbonimidoyl] benzoate Traditional Name: benzoic acid [(E)-N-[4-(4-nitrophenyl)triazol-1-yl]-C-phenyl-carbonimidoyl] ester Formula: C22H15N5O4 MolecularWeight: 413.3856

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=NN2C=C(N=N2)C3=CC=C(C=C3)[N+](=O)[O-])OC(=O)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)/C(=N\N2C=C(N=N2)C3=CC=C(C=C3)[N+](=O)[O-])/OC(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H15N5O4/c28-22(18-9-5-2-6-10-18)31-21(17-7-3-1-4-8-17)24-26-15-20(23-25-26)16-11-13-19(14-12-16)27(29)30/h1-15H/b24-21+