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

Systemtic Name: phenyl 4-[(1-oxidanylidene-4-phenyl-phthalazin-2-yl)methyl]benzoate Openeye Name: phenyl 4-[(1-oxo-4-phenyl-phthalazin-2-yl)methyl]benzoate CAS Name: 4-[(1-oxo-4-phenyl-2-phthalazinyl)methyl]benzoic acid phenyl ester IUPAC Name: phenyl 4-[(1-oxo-4-phenylphthalazin-2-yl)methyl]benzoate Traditional Name: 4-[(1-keto-4-phenyl-phthalazin-2-yl)methyl]benzoic acid phenyl ester Formula: C28H20N2O3 MolecularWeight: 432.47

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C(=O)C3=CC=CC=C32)CC4=CC=C(C=C4)C(=O)OC5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C(=O)C3=CC=CC=C32)CC4=CC=C(C=C4)C(=O)OC5=CC=CC=C5

InChI

InChI=1S/C28H20N2O3/c31-27-25-14-8-7-13-24(25)26(21-9-3-1-4-10-21)29-30(27)19-20-15-17-22(18-16-20)28(32)33-23-11-5-2-6-12-23/h1-18H,19H2