[4-bromanyl-2-[(E)-[2-(4-phenylmethoxyphenoxy)propanoylhydrazinylidene]methyl]phenyl] 3-methylbenzoate

Systemtic Name: [4-bromanyl-2-[(E)-[2-(4-phenylmethoxyphenoxy)propanoylhydrazinylidene]methyl]phenyl] 3-methylbenzoate Openeye Name: [2-[(E)-[2-(4-benzyloxyphenoxy)propanoylhydrazono]methyl]-4-bromo-phenyl] 3-methylbenzoate CAS Name: 3-methylbenzoic acid [4-bromo-2-[(E)-[[1-oxo-2-(4-phenylmethoxyphenoxy)propyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [4-bromo-2-[(E)-[2-(4-phenylmethoxyphenoxy)propanoylhydrazinylidene]methyl]phenyl] 3-methylbenzoate Traditional Name: 3-methylbenzoic acid [2-[(E)-[2-(4-benzoxyphenoxy)propanoylhydrazono]methyl]-4-bromo-phenyl] ester Formula: C31H27BrN2O5 MolecularWeight: 587.46048

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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)C(C)OC3=CC=C(C=C3)OCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)OC2=C(C=C(C=C2)Br)/C=N/NC(=O)C(C)OC3=CC=C(C=C3)OCC4=CC=CC=C4

InChI

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