[4-bromanyl-2-[(E)-[2-(2-methoxy-4-prop-2-enyl-phenoxy)ethanoylhydrazinylidene]methyl]phenyl] 3-methylbenzoate

Systemtic Name: [4-bromanyl-2-[(E)-[2-(2-methoxy-4-prop-2-enyl-phenoxy)ethanoylhydrazinylidene]methyl]phenyl] 3-methylbenzoate Openeye Name: [2-[(E)-[[2-(4-allyl-2-methoxy-phenoxy)acetyl]hydrazono]methyl]-4-bromo-phenyl] 3-methylbenzoate CAS Name: 3-methylbenzoic acid [4-bromo-2-[(E)-[[2-(2-methoxy-4-prop-2-enylphenoxy)-1-oxoethyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [4-bromo-2-[(E)-[[2-(2-methoxy-4-prop-2-enylphenoxy)acetyl]hydrazinylidene]methyl]phenyl] 3-methylbenzoate Traditional Name: 3-methylbenzoic acid [2-[(E)-[[2-(4-allyl-2-methoxy-phenoxy)acetyl]hydrazono]methyl]-4-bromo-phenyl] ester Formula: C27H25BrN2O5 MolecularWeight: 537.4018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)OC2=C(C=C(C=C2)Br)C=NNC(=O)COC3=C(C=C(C=C3)CC=C)OC

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)OC2=C(C=C(C=C2)Br)/C=N/NC(=O)COC3=C(C=C(C=C3)CC=C)OC

InChI

InChI=1S/C27H25BrN2O5/c1-4-6-19-9-11-24(25(14-19)33-3)34-17-26(31)30-29-16-21-15-22(28)10-12-23(21)35-27(32)20-8-5-7-18(2)13-20/h4-5,7-16H,1,6,17H2,2-3H3,(H,30,31)/b29-16+