[4-[(E)-(aminocarbonylhydrazinylidene)methyl]phenyl] 3-nitrobenzoate

Systemtic Name: [4-[(E)-(aminocarbonylhydrazinylidene)methyl]phenyl] 3-nitrobenzoate Openeye Name: [4-[(E)-(carbamoylhydrazono)methyl]phenyl] 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid [4-[(E)-(carbamoylhydrazinylidene)methyl]phenyl] ester IUPAC Name: [4-[(E)-(carbamoylhydrazinylidene)methyl]phenyl] 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid [4-[(E)-semicarbazonomethyl]phenyl] ester Formula: C15H12N4O5 MolecularWeight: 328.27958

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OC2=CC=C(C=C2)C=NNC(=O)N

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OC2=CC=C(C=C2)/C=N/NC(=O)N

InChI

InChI=1S/C15H12N4O5/c16-15(21)18-17-9-10-4-6-13(7-5-10)24-14(20)11-2-1-3-12(8-11)19(22)23/h1-9H,(H3,16,18,21)/b17-9+