methyl 2-[2-[1-oxidanylidene-4-(pyridin-3-ylmethyl)phthalazin-2-yl]ethanoylamino]benzoate

Systemtic Name: methyl 2-[2-[1-oxidanylidene-4-(pyridin-3-ylmethyl)phthalazin-2-yl]ethanoylamino]benzoate Openeye Name: methyl 2-[[2-[1-oxo-4-(3-pyridylmethyl)phthalazin-2-yl]acetyl]amino]benzoate CAS Name: 2-[[1-oxo-2-[1-oxo-4-(3-pyridinylmethyl)-2-phthalazinyl]ethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[2-[1-oxo-4-(pyridin-3-ylmethyl)phthalazin-2-yl]acetyl]amino]benzoate Traditional Name: 2-[[2-[1-keto-4-(3-pyridylmethyl)phthalazin-2-yl]acetyl]amino]benzoic acid methyl ester Formula: C24H20N4O4 MolecularWeight: 428.44

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=O)CN2C(=O)C3=CC=CC=C3C(=N2)CC4=CN=CC=C4

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=O)CN2C(=O)C3=CC=CC=C3C(=N2)CC4=CN=CC=C4

InChI

InChI=1S/C24H20N4O4/c1-32-24(31)19-10-4-5-11-20(19)26-22(29)15-28-23(30)18-9-3-2-8-17(18)21(27-28)13-16-7-6-12-25-14-16/h2-12,14H,13,15H2,1H3,(H,26,29)