2-[(2R)-1-(azepan-1-yl)-1-oxidanylidene-propan-2-yl]benzo[de]isoquinoline-1,3-dione

Systemtic Name: 2-[(2R)-1-(azepan-1-yl)-1-oxidanylidene-propan-2-yl]benzo[de]isoquinoline-1,3-dione Openeye Name: 2-[(1R)-2-(azepan-1-yl)-1-methyl-2-oxo-ethyl]benzo[de]isoquinoline-1,3-dione CAS Name: 2-[(2R)-1-(1-azepanyl)-1-oxopropan-2-yl]benzo[de]isoquinoline-1,3-dione IUPAC Name: 2-[(2R)-1-(azepan-1-yl)-1-oxopropan-2-yl]benzo[de]isoquinoline-1,3-dione Traditional Name: 2-[(1R)-2-(azepan-1-yl)-2-keto-1-methyl-ethyl]benzo[de]isoquinoline-1,3-quinone Formula: C21H22N2O3 MolecularWeight: 350.41098

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCCCC1)N2C(=O)C3=CC=CC4=C3C(=CC=C4)C2=O

Isomeric SMILES

C[C@H](C(=O)N1CCCCCC1)N2C(=O)C3=CC=CC4=C3C(=CC=C4)C2=O

InChI

InChI=1S/C21H22N2O3/c1-14(19(24)22-12-4-2-3-5-13-22)23-20(25)16-10-6-8-15-9-7-11-17(18(15)16)21(23)26/h6-11,14H,2-5,12-13H2,1H3/t14-/m1/s1