N-(6-methoxypyridin-3-yl)-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxamide

Systemtic Name: N-(6-methoxypyridin-3-yl)-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxamide Openeye Name: 3-benzyl-N-(6-methoxy-3-pyridyl)-4-oxo-phthalazine-1-carboxamide CAS Name: N-(6-methoxy-3-pyridinyl)-4-oxo-3-(phenylmethyl)-1-phthalazinecarboxamide IUPAC Name: 3-benzyl-N-(6-methoxypyridin-3-yl)-4-oxophthalazine-1-carboxamide Traditional Name: 3-benzyl-4-keto-N-(6-methoxy-3-pyridyl)phthalazine-1-carboxamide Formula: C22H18N4O3 MolecularWeight: 386.40332

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC=C(C=C1)NC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC4=CC=CC=C4

Isomeric SMILES

COC1=NC=C(C=C1)NC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC4=CC=CC=C4

InChI

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