[4-[(E)-[2-(4-bromanylnaphthalen-1-yl)ethanoylhydrazinylidene]methyl]-2-methoxy-phenyl] 4-nitrobenzoate

Systemtic Name: [4-[(E)-[2-(4-bromanylnaphthalen-1-yl)ethanoylhydrazinylidene]methyl]-2-methoxy-phenyl] 4-nitrobenzoate Openeye Name: [4-[(E)-[[2-(4-bromo-1-naphthyl)acetyl]hydrazono]methyl]-2-methoxy-phenyl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [4-[(E)-[[2-(4-bromo-1-naphthalenyl)-1-oxoethyl]hydrazinylidene]methyl]-2-methoxyphenyl] ester IUPAC Name: [4-[(E)-[[2-(4-bromonaphthalen-1-yl)acetyl]hydrazinylidene]methyl]-2-methoxyphenyl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [4-[(E)-[[2-(4-bromo-1-naphthyl)acetyl]hydrazono]methyl]-2-methoxy-phenyl] ester Formula: C27H20BrN3O6 MolecularWeight: 562.3682

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=NNC(=O)CC2=CC=C(C3=CC=CC=C23)Br)OC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=CC(=C1)/C=N/NC(=O)CC2=CC=C(C3=CC=CC=C23)Br)OC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C27H20BrN3O6/c1-36-25-14-17(6-13-24(25)37-27(33)18-7-10-20(11-8-18)31(34)35)16-29-30-26(32)15-19-9-12-23(28)22-5-3-2-4-21(19)22/h2-14,16H,15H2,1H3,(H,30,32)/b29-16+