[4-[(E)-[(3-bromophenyl)carbonylhydrazinylidene]methyl]phenyl] 4-butoxybenzoate

Systemtic Name: [4-[(E)-[(3-bromophenyl)carbonylhydrazinylidene]methyl]phenyl] 4-butoxybenzoate Openeye Name: [4-[(E)-[(3-bromobenzoyl)hydrazono]methyl]phenyl] 4-butoxybenzoate CAS Name: 4-butoxybenzoic acid [4-[(E)-[[(3-bromophenyl)-oxomethyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [4-[(E)-[(3-bromobenzoyl)hydrazinylidene]methyl]phenyl] 4-butoxybenzoate Traditional Name: 4-butoxybenzoic acid [4-[(E)-[(3-bromobenzoyl)hydrazono]methyl]phenyl] ester Formula: C25H23BrN2O4 MolecularWeight: 495.36512

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C=NNC(=O)C3=CC(=CC=C3)Br

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)/C=N/NC(=O)C3=CC(=CC=C3)Br

InChI

InChI=1S/C25H23BrN2O4/c1-2-3-15-31-22-13-9-19(10-14-22)25(30)32-23-11-7-18(8-12-23)17-27-28-24(29)20-5-4-6-21(26)16-20/h4-14,16-17H,2-3,15H2,1H3,(H,28,29)/b27-17+