N-[4-(azepan-1-yl)phenyl]-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-[4-(azepan-1-yl)phenyl]-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-[4-(azepan-1-yl)phenyl]-3-methyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[4-(1-azepanyl)phenyl]-3-methyl-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-[4-(azepan-1-yl)phenyl]-3-methyl-4-oxophthalazine-1-carboxamide Traditional Name: N-[4-(azepan-1-yl)phenyl]-4-keto-3-methyl-phthalazine-1-carboxamide Formula: C22H24N4O2 MolecularWeight: 376.45156

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC=C(C=C3)N4CCCCCC4

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC=C(C=C3)N4CCCCCC4

InChI

InChI=1S/C22H24N4O2/c1-25-22(28)19-9-5-4-8-18(19)20(24-25)21(27)23-16-10-12-17(13-11-16)26-14-6-2-3-7-15-26/h4-5,8-13H,2-3,6-7,14-15H2,1H3,(H,23,27)