[4-bromanyl-2-[(E)-[2-(naphthalen-1-ylcarbonylamino)ethanoylhydrazinylidene]methyl]phenyl] 3-methylbenzoate

Systemtic Name: [4-bromanyl-2-[(E)-[2-(naphthalen-1-ylcarbonylamino)ethanoylhydrazinylidene]methyl]phenyl] 3-methylbenzoate Openeye Name: [4-bromo-2-[(E)-[[2-(naphthalene-1-carbonylamino)acetyl]hydrazono]methyl]phenyl] 3-methylbenzoate CAS Name: 3-methylbenzoic acid [4-bromo-2-[(E)-[[2-[[1-naphthalenyl(oxo)methyl]amino]-1-oxoethyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [4-bromo-2-[(E)-[[2-(naphthalene-1-carbonylamino)acetyl]hydrazinylidene]methyl]phenyl] 3-methylbenzoate Traditional Name: 3-methylbenzoic acid [4-bromo-2-[(E)-[[2-(1-naphthoylamino)acetyl]hydrazono]methyl]phenyl] ester Formula: C28H22BrN3O4 MolecularWeight: 544.39598

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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)CNC(=O)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)OC2=C(C=C(C=C2)Br)/C=N/NC(=O)CNC(=O)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C28H22BrN3O4/c1-18-6-4-9-20(14-18)28(35)36-25-13-12-22(29)15-21(25)16-31-32-26(33)17-30-27(34)24-11-5-8-19-7-2-3-10-23(19)24/h2-16H,17H2,1H3,(H,30,34)(H,32,33)/b31-16+