2-(2-methylpropyl)-4,5,11,11a-tetrahydro-3H-[1,4]diazepino[1,2-a]indol-1-one

Systemtic Name: 2-(2-methylpropyl)-4,5,11,11a-tetrahydro-3H-[1,4]diazepino[1,2-a]indol-1-one Openeye Name: 2-isobutyl-4,5,11,11a-tetrahydro-3H-[1,4]diazepino[1,2-a]indol-1-one CAS Name: 2-(2-methylpropyl)-4,5,11,11a-tetrahydro-3H-[1,4]diazepino[1,2-a]indol-1-one IUPAC Name: 2-(2-methylpropyl)-4,5,11,11a-tetrahydro-3H-[1,4]diazepino[1,2-a]indol-1-one Traditional Name: 2-isobutyl-4,5,11,11a-tetrahydro-3H-[1,4]diazepin[1,2-a]indol-1-one Formula: C16H22N2O MolecularWeight: 258.35868

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1CCCN2C(C1=O)CC3=CC=CC=C32

Isomeric SMILES

CC(C)CN1CCCN2C(C1=O)CC3=CC=CC=C32

InChI

InChI=1S/C16H22N2O/c1-12(2)11-17-8-5-9-18-14-7-4-3-6-13(14)10-15(18)16(17)19/h3-4,6-7,12,15H,5,8-11H2,1-2H3