methyl 2-[2-(4-aminocarbonyl-1-oxidanylidene-phthalazin-2-yl)ethanoylamino]-4,5-dimethoxy-benzoate

Systemtic Name: methyl 2-[2-(4-aminocarbonyl-1-oxidanylidene-phthalazin-2-yl)ethanoylamino]-4,5-dimethoxy-benzoate Openeye Name: methyl 2-[[2-(4-carbamoyl-1-oxo-phthalazin-2-yl)acetyl]amino]-4,5-dimethoxy-benzoate CAS Name: 2-[[2-(4-carbamoyl-1-oxo-2-phthalazinyl)-1-oxoethyl]amino]-4,5-dimethoxybenzoic acid methyl ester IUPAC Name: methyl 2-[[2-(4-carbamoyl-1-oxophthalazin-2-yl)acetyl]amino]-4,5-dimethoxybenzoate Traditional Name: 2-[[2-(4-carbamoyl-1-keto-phthalazin-2-yl)acetyl]amino]-4,5-dimethoxy-benzoic acid methyl ester Formula: C21H20N4O7 MolecularWeight: 440.4061

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)OC)NC(=O)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)N)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)OC)NC(=O)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)N)OC

InChI

InChI=1S/C21H20N4O7/c1-30-15-8-13(21(29)32-3)14(9-16(15)31-2)23-17(26)10-25-20(28)12-7-5-4-6-11(12)18(24-25)19(22)27/h4-9H,10H2,1-3H3,(H2,22,27)(H,23,26)