[4-bromanyl-2-[(E)-(2,2-diphenoxyethanoylhydrazinylidene)methyl]phenyl] 4-propoxybenzoate

Systemtic Name: [4-bromanyl-2-[(E)-(2,2-diphenoxyethanoylhydrazinylidene)methyl]phenyl] 4-propoxybenzoate Openeye Name: [4-bromo-2-[(E)-[(2,2-diphenoxyacetyl)hydrazono]methyl]phenyl] 4-propoxybenzoate CAS Name: 4-propoxybenzoic acid [4-bromo-2-[(E)-[(1-oxo-2,2-diphenoxyethyl)hydrazinylidene]methyl]phenyl] ester IUPAC Name: [4-bromo-2-[(E)-[(2,2-diphenoxyacetyl)hydrazinylidene]methyl]phenyl] 4-propoxybenzoate Traditional Name: 4-propoxybenzoic acid [4-bromo-2-[(E)-[(2,2-diphenoxyacetyl)hydrazono]methyl]phenyl] ester Formula: C31H27BrN2O6 MolecularWeight: 603.45988

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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(OC3=CC=CC=C3)OC4=CC=CC=C4

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)Br)/C=N/NC(=O)C(OC3=CC=CC=C3)OC4=CC=CC=C4

InChI

InChI=1S/C31H27BrN2O6/c1-2-19-37-25-16-13-22(14-17-25)30(36)40-28-18-15-24(32)20-23(28)21-33-34-29(35)31(38-26-9-5-3-6-10-26)39-27-11-7-4-8-12-27/h3-18,20-21,31H,2,19H2,1H3,(H,34,35)/b33-21+