[4-bromanyl-2-[(E)-[(4-phenylmethoxyphenyl)carbonylhydrazinylidene]methyl]phenyl] 4-propoxybenzoate

Systemtic Name: [4-bromanyl-2-[(E)-[(4-phenylmethoxyphenyl)carbonylhydrazinylidene]methyl]phenyl] 4-propoxybenzoate Openeye Name: [2-[(E)-[(4-benzyloxybenzoyl)hydrazono]methyl]-4-bromo-phenyl] 4-propoxybenzoate CAS Name: 4-propoxybenzoic acid [4-bromo-2-[(E)-[[oxo-(4-phenylmethoxyphenyl)methyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [4-bromo-2-[(E)-[(4-phenylmethoxybenzoyl)hydrazinylidene]methyl]phenyl] 4-propoxybenzoate Traditional Name: 4-propoxybenzoic acid [2-[(E)-[(4-benzoxybenzoyl)hydrazono]methyl]-4-bromo-phenyl] ester Formula: C31H27BrN2O5 MolecularWeight: 587.46048

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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)C3=CC=C(C=C3)OCC4=CC=CC=C4

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)Br)/C=N/NC(=O)C3=CC=C(C=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C31H27BrN2O5/c1-2-18-37-27-15-10-24(11-16-27)31(36)39-29-17-12-26(32)19-25(29)20-33-34-30(35)23-8-13-28(14-9-23)38-21-22-6-4-3-5-7-22/h3-17,19-20H,2,18,21H2,1H3,(H,34,35)/b33-20+