4-oxidanylidene-N-[3-(2-oxidanylideneazepan-1-yl)propyl]-3H-phthalazine-1-carboxamide

Systemtic Name: 4-oxidanylidene-N-[3-(2-oxidanylideneazepan-1-yl)propyl]-3H-phthalazine-1-carboxamide Openeye Name: 4-oxo-N-[3-(2-oxoazepan-1-yl)propyl]-3H-phthalazine-1-carboxamide CAS Name: 4-oxo-N-[3-(2-oxo-1-azepanyl)propyl]-3H-phthalazine-1-carboxamide IUPAC Name: 4-oxo-N-[3-(2-oxoazepan-1-yl)propyl]-3H-phthalazine-1-carboxamide Traditional Name: 4-keto-N-[3-(2-ketoazepan-1-yl)propyl]-3H-phthalazine-1-carboxamide Formula: C18H22N4O3 MolecularWeight: 342.39228

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)N(CC1)CCCNC(=O)C2=NNC(=O)C3=CC=CC=C32

Isomeric SMILES

C1CCC(=O)N(CC1)CCCNC(=O)C2=NNC(=O)C3=CC=CC=C32

InChI

InChI=1S/C18H22N4O3/c23-15-9-2-1-5-11-22(15)12-6-10-19-18(25)16-13-7-3-4-8-14(13)17(24)21-20-16/h3-4,7-8H,1-2,5-6,9-12H2,(H,19,25)(H,21,24)