methyl 2-[4-(naphthalen-1-ylmethyl)-1-oxidanylidene-phthalazin-2-yl]-2-phenyl-ethanoate

Systemtic Name: methyl 2-[4-(naphthalen-1-ylmethyl)-1-oxidanylidene-phthalazin-2-yl]-2-phenyl-ethanoate Openeye Name: methyl 2-[4-(1-naphthylmethyl)-1-oxo-phthalazin-2-yl]-2-phenyl-acetate CAS Name: 2-[4-(1-naphthalenylmethyl)-1-oxo-2-phthalazinyl]-2-phenylacetic acid methyl ester IUPAC Name: methyl 2-[4-(naphthalen-1-ylmethyl)-1-oxophthalazin-2-yl]-2-phenylacetate Traditional Name: 2-[1-keto-4-(1-naphthylmethyl)phthalazin-2-yl]-2-phenyl-acetic acid methyl ester Formula: C28H22N2O3 MolecularWeight: 434.48588

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1=CC=CC=C1)N2C(=O)C3=CC=CC=C3C(=N2)CC4=CC=CC5=CC=CC=C54

Isomeric SMILES

COC(=O)C(C1=CC=CC=C1)N2C(=O)C3=CC=CC=C3C(=N2)CC4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C28H22N2O3/c1-33-28(32)26(20-11-3-2-4-12-20)30-27(31)24-17-8-7-16-23(24)25(29-30)18-21-14-9-13-19-10-5-6-15-22(19)21/h2-17,26H,18H2,1H3