[4-bromanyl-2-[(E)-[2-[(4-methylphenyl)carbonylamino]ethanoylhydrazinylidene]methyl]phenyl] 3,4-dimethoxybenzoate

Systemtic Name: [4-bromanyl-2-[(E)-[2-[(4-methylphenyl)carbonylamino]ethanoylhydrazinylidene]methyl]phenyl] 3,4-dimethoxybenzoate Openeye Name: [4-bromo-2-[(E)-[[2-[(4-methylbenzoyl)amino]acetyl]hydrazono]methyl]phenyl] 3,4-dimethoxybenzoate CAS Name: 3,4-dimethoxybenzoic acid [4-bromo-2-[(E)-[[2-[[(4-methylphenyl)-oxomethyl]amino]-1-oxoethyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [4-bromo-2-[(E)-[[2-[(4-methylbenzoyl)amino]acetyl]hydrazinylidene]methyl]phenyl] 3,4-dimethoxybenzoate Traditional Name: 3,4-dimethoxybenzoic acid [4-bromo-2-[(E)-[[2-(p-toluoylamino)acetyl]hydrazono]methyl]phenyl] ester Formula: C26H24BrN3O6 MolecularWeight: 554.38926

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NCC(=O)NN=CC2=C(C=CC(=C2)Br)OC(=O)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NCC(=O)N/N=C/C2=C(C=CC(=C2)Br)OC(=O)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C26H24BrN3O6/c1-16-4-6-17(7-5-16)25(32)28-15-24(31)30-29-14-19-12-20(27)9-11-21(19)36-26(33)18-8-10-22(34-2)23(13-18)35-3/h4-14H,15H2,1-3H3,(H,28,32)(H,30,31)/b29-14+