3-(3-methoxyphenyl)-4-oxidanylidene-N-(pyridin-3-ylmethyl)phthalazine-1-carboxamide

Systemtic Name: 3-(3-methoxyphenyl)-4-oxidanylidene-N-(pyridin-3-ylmethyl)phthalazine-1-carboxamide Openeye Name: 3-(3-methoxyphenyl)-4-oxo-N-(3-pyridylmethyl)phthalazine-1-carboxamide CAS Name: 3-(3-methoxyphenyl)-4-oxo-N-(3-pyridinylmethyl)-1-phthalazinecarboxamide IUPAC Name: 3-(3-methoxyphenyl)-4-oxo-N-(pyridin-3-ylmethyl)phthalazine-1-carboxamide Traditional Name: 4-keto-3-(3-methoxyphenyl)-N-(3-pyridylmethyl)phthalazine-1-carboxamide Formula: C22H18N4O3 MolecularWeight: 386.40332

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)NCC4=CN=CC=C4

Isomeric SMILES

COC1=CC=CC(=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)NCC4=CN=CC=C4

InChI

InChI=1S/C22H18N4O3/c1-29-17-8-4-7-16(12-17)26-22(28)19-10-3-2-9-18(19)20(25-26)21(27)24-14-15-6-5-11-23-13-15/h2-13H,14H2,1H3,(H,24,27)