[4-bromanyl-2-[(E)-[(2-oxidanylidene-2-phenylazanyl-ethanoyl)hydrazinylidene]methyl]phenyl] 4-propoxybenzoate

Systemtic Name: [4-bromanyl-2-[(E)-[(2-oxidanylidene-2-phenylazanyl-ethanoyl)hydrazinylidene]methyl]phenyl] 4-propoxybenzoate Openeye Name: [2-[(E)-[(2-anilino-2-oxo-acetyl)hydrazono]methyl]-4-bromo-phenyl] 4-propoxybenzoate CAS Name: 4-propoxybenzoic acid [2-[(E)-[(2-anilino-1,2-dioxoethyl)hydrazinylidene]methyl]-4-bromophenyl] ester IUPAC Name: [2-[(E)-[(2-anilino-2-oxoacetyl)hydrazinylidene]methyl]-4-bromophenyl] 4-propoxybenzoate Traditional Name: 4-propoxybenzoic acid [2-[(E)-[(2-anilino-2-keto-acetyl)hydrazono]methyl]-4-bromo-phenyl] ester Formula: C25H22BrN3O5 MolecularWeight: 524.36328

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)Br)C=NNC(=O)C(=O)NC3=CC=CC=C3

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)Br)/C=N/NC(=O)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C25H22BrN3O5/c1-2-14-33-21-11-8-17(9-12-21)25(32)34-22-13-10-19(26)15-18(22)16-27-29-24(31)23(30)28-20-6-4-3-5-7-20/h3-13,15-16H,2,14H2,1H3,(H,28,30)(H,29,31)/b27-16+