[2-methoxy-4-[(E)-[(5-nitropyridin-2-yl)hydrazinylidene]methyl]phenyl] 4-methylbenzoate

Systemtic Name: [2-methoxy-4-[(E)-[(5-nitropyridin-2-yl)hydrazinylidene]methyl]phenyl] 4-methylbenzoate Openeye Name: [2-methoxy-4-[(E)-[(5-nitro-2-pyridyl)hydrazono]methyl]phenyl] 4-methylbenzoate CAS Name: 4-methylbenzoic acid [2-methoxy-4-[(E)-[(5-nitro-2-pyridinyl)hydrazinylidene]methyl]phenyl] ester IUPAC Name: [2-methoxy-4-[(E)-[(5-nitropyridin-2-yl)hydrazinylidene]methyl]phenyl] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [2-methoxy-4-[(E)-[(5-nitro-2-pyridyl)hydrazono]methyl]phenyl] ester Formula: C21H18N4O5 MolecularWeight: 406.39142

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)C=NNC3=NC=C(C=C3)[N+](=O)[O-])OC

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)/C=N/NC3=NC=C(C=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C21H18N4O5/c1-14-3-6-16(7-4-14)21(26)30-18-9-5-15(11-19(18)29-2)12-23-24-20-10-8-17(13-22-20)25(27)28/h3-13H,1-2H3,(H,22,24)/b23-12+