methyl 3-[4-(4-methylphenyl)-1-oxidanylidene-phthalazin-2-yl]propanoate

Systemtic Name: methyl 3-[4-(4-methylphenyl)-1-oxidanylidene-phthalazin-2-yl]propanoate Openeye Name: methyl 3-[1-oxo-4-(p-tolyl)phthalazin-2-yl]propanoate CAS Name: 3-[4-(4-methylphenyl)-1-oxo-2-phthalazinyl]propanoic acid methyl ester IUPAC Name: methyl 3-[4-(4-methylphenyl)-1-oxophthalazin-2-yl]propanoate Traditional Name: 3-[1-keto-4-(p-tolyl)phthalazin-2-yl]propionic acid methyl ester Formula: C19H18N2O3 MolecularWeight: 322.35782

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C(=O)C3=CC=CC=C32)CCC(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C(=O)C3=CC=CC=C32)CCC(=O)OC

InChI

InChI=1S/C19H18N2O3/c1-13-7-9-14(10-8-13)18-15-5-3-4-6-16(15)19(23)21(20-18)12-11-17(22)24-2/h3-10H,11-12H2,1-2H3