(phenylmethyl) 4-[(1-oxidanylidene-4-phenyl-phthalazin-2-yl)methyl]benzoate

Systemtic Name: (phenylmethyl) 4-[(1-oxidanylidene-4-phenyl-phthalazin-2-yl)methyl]benzoate Openeye Name: benzyl 4-[(1-oxo-4-phenyl-phthalazin-2-yl)methyl]benzoate CAS Name: 4-[(1-oxo-4-phenyl-2-phthalazinyl)methyl]benzoic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[(1-oxo-4-phenylphthalazin-2-yl)methyl]benzoate Traditional Name: 4-[(1-keto-4-phenyl-phthalazin-2-yl)methyl]benzoic acid benzyl ester Formula: C29H22N2O3 MolecularWeight: 446.49658

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)C2=CC=C(C=C2)CN3C(=O)C4=CC=CC=C4C(=N3)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)C2=CC=C(C=C2)CN3C(=O)C4=CC=CC=C4C(=N3)C5=CC=CC=C5

InChI

InChI=1S/C29H22N2O3/c32-28-26-14-8-7-13-25(26)27(23-11-5-2-6-12-23)30-31(28)19-21-15-17-24(18-16-21)29(33)34-20-22-9-3-1-4-10-22/h1-18H,19-20H2