methyl 2-[3-[1,4-bis(oxidanylidene)-3H-phthalazin-2-yl]propanoylamino]benzoate

Systemtic Name: methyl 2-[3-[1,4-bis(oxidanylidene)-3H-phthalazin-2-yl]propanoylamino]benzoate Openeye Name: methyl 2-[3-(1,4-dioxo-3H-phthalazin-2-yl)propanoylamino]benzoate CAS Name: 2-[[3-(1,4-dioxo-3H-phthalazin-2-yl)-1-oxopropyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[3-(1,4-dioxo-3H-phthalazin-2-yl)propanoylamino]benzoate Traditional Name: 2-[3-(1,4-diketo-3H-phthalazin-2-yl)propanoylamino]benzoic acid methyl ester Formula: C19H17N3O5 MolecularWeight: 367.35538

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=O)CCN2C(=O)C3=CC=CC=C3C(=O)N2

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=O)CCN2C(=O)C3=CC=CC=C3C(=O)N2

InChI

InChI=1S/C19H17N3O5/c1-27-19(26)14-8-4-5-9-15(14)20-16(23)10-11-22-18(25)13-7-3-2-6-12(13)17(24)21-22/h2-9H,10-11H2,1H3,(H,20,23)(H,21,24)