[1-[(E)-[(2-oxidanyl-2-phenyl-ethanoyl)hydrazinylidene]methyl]naphthalen-2-yl] 4-methylbenzoate

Systemtic Name: [1-[(E)-[(2-oxidanyl-2-phenyl-ethanoyl)hydrazinylidene]methyl]naphthalen-2-yl] 4-methylbenzoate Openeye Name: [1-[(E)-[(2-hydroxy-2-phenyl-acetyl)hydrazono]methyl]-2-naphthyl] 4-methylbenzoate CAS Name: 4-methylbenzoic acid [1-[(E)-[(2-hydroxy-1-oxo-2-phenylethyl)hydrazinylidene]methyl]-2-naphthalenyl] ester IUPAC Name: [1-[(E)-[(2-hydroxy-2-phenylacetyl)hydrazinylidene]methyl]naphthalen-2-yl] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [1-[(E)-(mandeloylhydrazono)methyl]-2-naphthyl] ester Formula: C27H22N2O4 MolecularWeight: 438.47458

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OC2=C(C3=CC=CC=C3C=C2)C=NNC(=O)C(C4=CC=CC=C4)O

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)OC2=C(C3=CC=CC=C3C=C2)/C=N/NC(=O)C(C4=CC=CC=C4)O

InChI

InChI=1S/C27H22N2O4/c1-18-11-13-21(14-12-18)27(32)33-24-16-15-19-7-5-6-10-22(19)23(24)17-28-29-26(31)25(30)20-8-3-2-4-9-20/h2-17,25,30H,1H3,(H,29,31)/b28-17+