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

Systemtic Name: 4-oxidanylidene-N-(2-oxidanylideneazepan-3-yl)-3-propan-2-yl-phthalazine-1-carboxamide Openeye Name: 3-isopropyl-4-oxo-N-(2-oxoazepan-3-yl)phthalazine-1-carboxamide CAS Name: 4-oxo-N-(2-oxo-3-azepanyl)-3-propan-2-yl-1-phthalazinecarboxamide IUPAC Name: 4-oxo-N-(2-oxoazepan-3-yl)-3-propan-2-ylphthalazine-1-carboxamide Traditional Name: 3-isopropyl-4-keto-N-(2-ketoazepan-3-yl)phthalazine-1-carboxamide Formula: C18H22N4O3 MolecularWeight: 342.39228

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3CCCCNC3=O

Isomeric SMILES

CC(C)N1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3CCCCNC3=O

InChI

InChI=1S/C18H22N4O3/c1-11(2)22-18(25)13-8-4-3-7-12(13)15(21-22)17(24)20-14-9-5-6-10-19-16(14)23/h3-4,7-8,11,14H,5-6,9-10H2,1-2H3,(H,19,23)(H,20,24)