[4-bromanyl-2-[(E)-[(4-butoxyphenyl)carbonylhydrazinylidene]methyl]phenyl] 3,4-dimethoxybenzoate

Systemtic Name: [4-bromanyl-2-[(E)-[(4-butoxyphenyl)carbonylhydrazinylidene]methyl]phenyl] 3,4-dimethoxybenzoate Openeye Name: [4-bromo-2-[(E)-[(4-butoxybenzoyl)hydrazono]methyl]phenyl] 3,4-dimethoxybenzoate CAS Name: 3,4-dimethoxybenzoic acid [4-bromo-2-[(E)-[[(4-butoxyphenyl)-oxomethyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [4-bromo-2-[(E)-[(4-butoxybenzoyl)hydrazinylidene]methyl]phenyl] 3,4-dimethoxybenzoate Traditional Name: 3,4-dimethoxybenzoic acid [4-bromo-2-[(E)-[(4-butoxybenzoyl)hydrazono]methyl]phenyl] ester Formula: C27H27BrN2O6 MolecularWeight: 555.41708

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NN=CC2=C(C=CC(=C2)Br)OC(=O)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)N/N=C/C2=C(C=CC(=C2)Br)OC(=O)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C27H27BrN2O6/c1-4-5-14-35-22-10-6-18(7-11-22)26(31)30-29-17-20-15-21(28)9-13-23(20)36-27(32)19-8-12-24(33-2)25(16-19)34-3/h6-13,15-17H,4-5,14H2,1-3H3,(H,30,31)/b29-17+