2-[1-(azepan-1-yl)-1-oxidanylidene-propan-2-yl]isoindole-1,3-dione

Systemtic Name: 2-[1-(azepan-1-yl)-1-oxidanylidene-propan-2-yl]isoindole-1,3-dione Openeye Name: 2-[2-(azepan-1-yl)-1-methyl-2-oxo-ethyl]isoindoline-1,3-dione CAS Name: 2-[1-(1-azepanyl)-1-oxopropan-2-yl]isoindole-1,3-dione IUPAC Name: 2-[1-(azepan-1-yl)-1-oxopropan-2-yl]isoindole-1,3-dione Traditional Name: 2-[2-(azepan-1-yl)-2-keto-1-methyl-ethyl]isoindoline-1,3-quinone Formula: C17H20N2O3 MolecularWeight: 300.3523

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCCCC1)N2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CC(C(=O)N1CCCCCC1)N2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C17H20N2O3/c1-12(15(20)18-10-6-2-3-7-11-18)19-16(21)13-8-4-5-9-14(13)17(19)22/h4-5,8-9,12H,2-3,6-7,10-11H2,1H3