3-methyl-4-oxidanylidene-N-(2-oxidanylideneazepan-3-yl)phthalazine-1-carboxamide

Systemtic Name: 3-methyl-4-oxidanylidene-N-(2-oxidanylideneazepan-3-yl)phthalazine-1-carboxamide Openeye Name: 3-methyl-4-oxo-N-(2-oxoazepan-3-yl)phthalazine-1-carboxamide CAS Name: 3-methyl-4-oxo-N-(2-oxo-3-azepanyl)-1-phthalazinecarboxamide IUPAC Name: 3-methyl-4-oxo-N-(2-oxoazepan-3-yl)phthalazine-1-carboxamide Traditional Name: 4-keto-N-(2-ketoazepan-3-yl)-3-methyl-phthalazine-1-carboxamide Formula: C16H18N4O3 MolecularWeight: 314.33912

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3CCCCNC3=O

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3CCCCNC3=O

InChI

InChI=1S/C16H18N4O3/c1-20-16(23)11-7-3-2-6-10(11)13(19-20)15(22)18-12-8-4-5-9-17-14(12)21/h2-3,6-7,12H,4-5,8-9H2,1H3,(H,17,21)(H,18,22)