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

Systemtic Name: N-(5-chloranylpyridin-2-yl)-3-(4-ethoxyphenyl)-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-(5-chloro-2-pyridyl)-3-(4-ethoxyphenyl)-4-oxo-phthalazine-1-carboxamide CAS Name: N-(5-chloro-2-pyridinyl)-3-(4-ethoxyphenyl)-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-(5-chloropyridin-2-yl)-3-(4-ethoxyphenyl)-4-oxophthalazine-1-carboxamide Traditional Name: N-(5-chloro-2-pyridyl)-4-keto-3-p-phenetyl-phthalazine-1-carboxamide Formula: C22H17ClN4O3 MolecularWeight: 420.84838

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)NC4=NC=C(C=C4)Cl

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)NC4=NC=C(C=C4)Cl

InChI

InChI=1S/C22H17ClN4O3/c1-2-30-16-10-8-15(9-11-16)27-22(29)18-6-4-3-5-17(18)20(26-27)21(28)25-19-12-7-14(23)13-24-19/h3-13H,2H2,1H3,(H,24,25,28)