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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCNC(=O)C1=NN(C(=O)C2=CC=CC=C21)CC3=CC=CC=C3

Isomeric SMILES

COC(=O)CCNC(=O)C1=NN(C(=O)C2=CC=CC=C21)CC3=CC=CC=C3

InChI

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