N-(5-chloranylpyridin-2-yl)-3-(3-methoxyphenyl)-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-(5-chloranylpyridin-2-yl)-3-(3-methoxyphenyl)-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-(5-chloro-2-pyridyl)-3-(3-methoxyphenyl)-4-oxo-phthalazine-1-carboxamide CAS Name: N-(5-chloro-2-pyridinyl)-3-(3-methoxyphenyl)-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-(5-chloropyridin-2-yl)-3-(3-methoxyphenyl)-4-oxophthalazine-1-carboxamide Traditional Name: N-(5-chloro-2-pyridyl)-4-keto-3-(3-methoxyphenyl)phthalazine-1-carboxamide Formula: C21H15ClN4O3 MolecularWeight: 406.8218

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)NC4=NC=C(C=C4)Cl

Isomeric SMILES

COC1=CC=CC(=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)NC4=NC=C(C=C4)Cl

InChI

InChI=1S/C21H15ClN4O3/c1-29-15-6-4-5-14(11-15)26-21(28)17-8-3-2-7-16(17)19(25-26)20(27)24-18-10-9-13(22)12-23-18/h2-12H,1H3,(H,23,24,27)