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

Systemtic Name: [4-bromanyl-2-[(E)-[2-(2-methoxy-4-prop-2-enyl-phenoxy)ethanoylhydrazinylidene]methyl]phenyl] 2-methylbenzoate Openeye Name: [2-[(E)-[[2-(4-allyl-2-methoxy-phenoxy)acetyl]hydrazono]methyl]-4-bromo-phenyl] 2-methylbenzoate CAS Name: 2-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] 2-methylbenzoate Traditional Name: 2-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=C1C(=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=C1C(=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/c1-4-7-19-10-12-24(25(14-19)33-3)34-17-26(31)30-29-16-20-15-21(28)11-13-23(20)35-27(32)22-9-6-5-8-18(22)2/h4-6,8-16H,1,7,17H2,2-3H3,(H,30,31)/b29-16+