[1-[(E)-[(4-bromophenyl)carbonylhydrazinylidene]methyl]naphthalen-2-yl] 3,4-dimethoxybenzoate

Systemtic Name: [1-[(E)-[(4-bromophenyl)carbonylhydrazinylidene]methyl]naphthalen-2-yl] 3,4-dimethoxybenzoate Openeye Name: [1-[(E)-[(4-bromobenzoyl)hydrazono]methyl]-2-naphthyl] 3,4-dimethoxybenzoate CAS Name: 3,4-dimethoxybenzoic acid [1-[(E)-[[(4-bromophenyl)-oxomethyl]hydrazinylidene]methyl]-2-naphthalenyl] ester IUPAC Name: [1-[(E)-[(4-bromobenzoyl)hydrazinylidene]methyl]naphthalen-2-yl] 3,4-dimethoxybenzoate Traditional Name: 3,4-dimethoxybenzoic acid [1-[(E)-[(4-bromobenzoyl)hydrazono]methyl]-2-naphthyl] ester Formula: C27H21BrN2O5 MolecularWeight: 533.37004

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)OC2=C(C3=CC=CC=C3C=C2)C=NNC(=O)C4=CC=C(C=C4)Br)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)OC2=C(C3=CC=CC=C3C=C2)/C=N/NC(=O)C4=CC=C(C=C4)Br)OC

InChI

InChI=1S/C27H21BrN2O5/c1-33-24-14-10-19(15-25(24)34-2)27(32)35-23-13-9-17-5-3-4-6-21(17)22(23)16-29-30-26(31)18-7-11-20(28)12-8-18/h3-16H,1-2H3,(H,30,31)/b29-16+