[4-[(E)-[(2,4-dinitrophenyl)hydrazinylidene]methyl]-2-methoxy-phenyl] 3-bromanylbenzoate

Systemtic Name: [4-[(E)-[(2,4-dinitrophenyl)hydrazinylidene]methyl]-2-methoxy-phenyl] 3-bromanylbenzoate Openeye Name: [4-[(E)-[(2,4-dinitrophenyl)hydrazono]methyl]-2-methoxy-phenyl] 3-bromobenzoate CAS Name: 3-bromobenzoic acid [4-[(E)-[(2,4-dinitrophenyl)hydrazinylidene]methyl]-2-methoxyphenyl] ester IUPAC Name: [4-[(E)-[(2,4-dinitrophenyl)hydrazinylidene]methyl]-2-methoxyphenyl] 3-bromobenzoate Traditional Name: 3-bromobenzoic acid [4-[(E)-[(2,4-dinitrophenyl)hydrazono]methyl]-2-methoxy-phenyl] ester Formula: C21H15BrN4O7 MolecularWeight: 515.2704

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=NNC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])OC(=O)C3=CC(=CC=C3)Br

Isomeric SMILES

COC1=C(C=CC(=C1)/C=N/NC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])OC(=O)C3=CC(=CC=C3)Br

InChI

InChI=1S/C21H15BrN4O7/c1-32-20-9-13(5-8-19(20)33-21(27)14-3-2-4-15(22)10-14)12-23-24-17-7-6-16(25(28)29)11-18(17)26(30)31/h2-12,24H,1H3/b23-12+