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

Systemtic Name: methyl 3-(4-methylphenyl)-3-[(4-oxidanylidene-3H-phthalazin-1-yl)carbonylamino]propanoate Openeye Name: methyl 3-[(4-oxo-3H-phthalazine-1-carbonyl)amino]-3-(p-tolyl)propanoate CAS Name: 3-(4-methylphenyl)-3-[[oxo-(4-oxo-3H-phthalazin-1-yl)methyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-(4-methylphenyl)-3-[(4-oxo-3H-phthalazine-1-carbonyl)amino]propanoate Traditional Name: 3-[(4-keto-3H-phthalazine-1-carbonyl)amino]-3-(p-tolyl)propionic acid methyl ester Formula: C20H19N3O4 MolecularWeight: 365.38256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(CC(=O)OC)NC(=O)C2=NNC(=O)C3=CC=CC=C32

Isomeric SMILES

CC1=CC=C(C=C1)C(CC(=O)OC)NC(=O)C2=NNC(=O)C3=CC=CC=C32

InChI

InChI=1S/C20H19N3O4/c1-12-7-9-13(10-8-12)16(11-17(24)27-2)21-20(26)18-14-5-3-4-6-15(14)19(25)23-22-18/h3-10,16H,11H2,1-2H3,(H,21,26)(H,23,25)