[4-bromanyl-2-[(E)-[(4-butoxyphenyl)carbonylhydrazinylidene]methyl]phenyl] 2-methylbenzoate

Systemtic Name: [4-bromanyl-2-[(E)-[(4-butoxyphenyl)carbonylhydrazinylidene]methyl]phenyl] 2-methylbenzoate Openeye Name: [4-bromo-2-[(E)-[(4-butoxybenzoyl)hydrazono]methyl]phenyl] 2-methylbenzoate CAS Name: 2-methylbenzoic acid [4-bromo-2-[(E)-[[(4-butoxyphenyl)-oxomethyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [4-bromo-2-[(E)-[(4-butoxybenzoyl)hydrazinylidene]methyl]phenyl] 2-methylbenzoate Traditional Name: 2-methylbenzoic acid [4-bromo-2-[(E)-[(4-butoxybenzoyl)hydrazono]methyl]phenyl] ester Formula: C26H25BrN2O4 MolecularWeight: 509.3917

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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=CC=C3C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)N/N=C/C2=C(C=CC(=C2)Br)OC(=O)C3=CC=CC=C3C

InChI

InChI=1S/C26H25BrN2O4/c1-3-4-15-32-22-12-9-19(10-13-22)25(30)29-28-17-20-16-21(27)11-14-24(20)33-26(31)23-8-6-5-7-18(23)2/h5-14,16-17H,3-4,15H2,1-2H3,(H,29,30)/b28-17+