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

Systemtic Name: 2-[1-(azepan-1-yl)-3-methyl-1-oxidanylidene-butan-2-yl]isoindole-1,3-dione Openeye Name: 2-[1-(azepane-1-carbonyl)-2-methyl-propyl]isoindoline-1,3-dione CAS Name: 2-[1-(1-azepanyl)-3-methyl-1-oxobutan-2-yl]isoindole-1,3-dione IUPAC Name: 2-[1-(azepan-1-yl)-3-methyl-1-oxobutan-2-yl]isoindole-1,3-dione Traditional Name: 2-[1-(azepane-1-carbonyl)-2-methyl-propyl]isoindoline-1,3-quinone Formula: C19H24N2O3 MolecularWeight: 328.40546

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H24N2O3/c1-13(2)16(19(24)20-11-7-3-4-8-12-20)21-17(22)14-9-5-6-10-15(14)18(21)23/h5-6,9-10,13,16H,3-4,7-8,11-12H2,1-2H3