methyl 3-(3,4-dimethoxyphenyl)-3-[(3-methyl-4-oxidanylidene-phthalazin-1-yl)carbonylamino]propanoate

Systemtic Name: methyl 3-(3,4-dimethoxyphenyl)-3-[(3-methyl-4-oxidanylidene-phthalazin-1-yl)carbonylamino]propanoate Openeye Name: methyl 3-(3,4-dimethoxyphenyl)-3-[(3-methyl-4-oxo-phthalazine-1-carbonyl)amino]propanoate CAS Name: 3-(3,4-dimethoxyphenyl)-3-[[(3-methyl-4-oxo-1-phthalazinyl)-oxomethyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-(3,4-dimethoxyphenyl)-3-[(3-methyl-4-oxophthalazine-1-carbonyl)amino]propanoate Traditional Name: 3-(3,4-dimethoxyphenyl)-3-[(4-keto-3-methyl-phthalazine-1-carbonyl)amino]propionic acid methyl ester Formula: C22H23N3O6 MolecularWeight: 425.43452

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC(CC(=O)OC)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC(CC(=O)OC)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C22H23N3O6/c1-25-22(28)15-8-6-5-7-14(15)20(24-25)21(27)23-16(12-19(26)31-4)13-9-10-17(29-2)18(11-13)30-3/h5-11,16H,12H2,1-4H3,(H,23,27)