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

Systemtic Name: [4-bromanyl-2-[(E)-[(4-butoxyphenyl)carbonylhydrazinylidene]methyl]phenyl] 2-chloranylbenzoate Openeye Name: [4-bromo-2-[(E)-[(4-butoxybenzoyl)hydrazono]methyl]phenyl] 2-chlorobenzoate CAS Name: 2-chlorobenzoic acid [4-bromo-2-[(E)-[[(4-butoxyphenyl)-oxomethyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [4-bromo-2-[(E)-[(4-butoxybenzoyl)hydrazinylidene]methyl]phenyl] 2-chlorobenzoate Traditional Name: 2-chlorobenzoic acid [4-bromo-2-[(E)-[(4-butoxybenzoyl)hydrazono]methyl]phenyl] ester Formula: C25H22BrClN2O4 MolecularWeight: 529.81018

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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=C3Cl

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)N/N=C/C2=C(C=CC(=C2)Br)OC(=O)C3=CC=CC=C3Cl

InChI

InChI=1S/C25H22BrClN2O4/c1-2-3-14-32-20-11-8-17(9-12-20)24(30)29-28-16-18-15-19(26)10-13-23(18)33-25(31)21-6-4-5-7-22(21)27/h4-13,15-16H,2-3,14H2,1H3,(H,29,30)/b28-16+