methyl 4-[(4-oxidanylidene-3-phenyl-phthalazin-1-yl)carbonylamino]butanoate

Systemtic Name: methyl 4-[(4-oxidanylidene-3-phenyl-phthalazin-1-yl)carbonylamino]butanoate Openeye Name: methyl 4-[(4-oxo-3-phenyl-phthalazine-1-carbonyl)amino]butanoate CAS Name: 4-[[oxo-(4-oxo-3-phenyl-1-phthalazinyl)methyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-[(4-oxo-3-phenylphthalazine-1-carbonyl)amino]butanoate Traditional Name: 4-[(4-keto-3-phenyl-phthalazine-1-carbonyl)amino]butyric acid methyl ester Formula: C20H19N3O4 MolecularWeight: 365.38256

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCNC(=O)C1=NN(C(=O)C2=CC=CC=C21)C3=CC=CC=C3

Isomeric SMILES

COC(=O)CCCNC(=O)C1=NN(C(=O)C2=CC=CC=C21)C3=CC=CC=C3

InChI

InChI=1S/C20H19N3O4/c1-27-17(24)12-7-13-21-19(25)18-15-10-5-6-11-16(15)20(26)23(22-18)14-8-3-2-4-9-14/h2-6,8-11H,7,12-13H2,1H3,(H,21,25)