(2R)-2-(azepan-1-ium-1-yl)-1-(1H-indol-3-yl)propan-1-one

Systemtic Name: (2R)-2-(azepan-1-ium-1-yl)-1-(1H-indol-3-yl)propan-1-one Openeye Name: (2R)-2-(azepan-1-ium-1-yl)-1-(1H-indol-3-yl)propan-1-one CAS Name: (2R)-2-(1-azepan-1-iumyl)-1-(1H-indol-3-yl)-1-propanone IUPAC Name: (2R)-2-(azepan-1-ium-1-yl)-1-(1H-indol-3-yl)propan-1-one Traditional Name: (2R)-2-(azepan-1-ium-1-yl)-1-(1H-indol-3-yl)propan-1-one Formula: C17H23N2O+ MolecularWeight: 271.37732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CNC2=CC=CC=C21)[NH+]3CCCCCC3

Isomeric SMILES

C[C@H](C(=O)C1=CNC2=CC=CC=C21)[NH+]3CCCCCC3

InChI

InChI=1S/C17H22N2O/c1-13(19-10-6-2-3-7-11-19)17(20)15-12-18-16-9-5-4-8-14(15)16/h4-5,8-9,12-13,18H,2-3,6-7,10-11H2,1H3/p+1/t13-/m1/s1