[4-[(E)-[(2,4-dinitrophenyl)hydrazinylidene]methyl]phenyl] 2-nitrobenzoate

Systemtic Name: [4-[(E)-[(2,4-dinitrophenyl)hydrazinylidene]methyl]phenyl] 2-nitrobenzoate Openeye Name: [4-[(E)-[(2,4-dinitrophenyl)hydrazono]methyl]phenyl] 2-nitrobenzoate CAS Name: 2-nitrobenzoic acid [4-[(E)-[(2,4-dinitrophenyl)hydrazinylidene]methyl]phenyl] ester IUPAC Name: [4-[(E)-[(2,4-dinitrophenyl)hydrazinylidene]methyl]phenyl] 2-nitrobenzoate Traditional Name: 2-nitrobenzoic acid [4-[(E)-[(2,4-dinitrophenyl)hydrazono]methyl]phenyl] ester Formula: C20H13N5O8 MolecularWeight: 451.34592

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)OC2=CC=C(C=C2)C=NNC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)OC2=CC=C(C=C2)/C=N/NC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C20H13N5O8/c26-20(16-3-1-2-4-18(16)24(29)30)33-15-8-5-13(6-9-15)12-21-22-17-10-7-14(23(27)28)11-19(17)25(31)32/h1-12,22H/b21-12+