2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-1-piperazin-4-ium-1-yl-ethanone

Systemtic Name: 2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-1-piperazin-4-ium-1-yl-ethanone Openeye Name: 2-[(2S)-2-methylindolin-1-yl]-1-piperazin-4-ium-1-yl-ethanone CAS Name: 2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-1-(1-piperazin-4-iumyl)ethanone IUPAC Name: 2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-1-piperazin-4-ium-1-ylethanone Traditional Name: 2-[(2S)-2-methylindolin-1-yl]-1-piperazin-4-ium-1-yl-ethanone Formula: C15H22N3O+ MolecularWeight: 260.35468

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=CC=CC=C2N1CC(=O)N3CC[NH2+]CC3

Isomeric SMILES

C[C@H]1CC2=CC=CC=C2N1CC(=O)N3CC[NH2+]CC3

InChI

InChI=1S/C15H21N3O/c1-12-10-13-4-2-3-5-14(13)18(12)11-15(19)17-8-6-16-7-9-17/h2-5,12,16H,6-11H2,1H3/p+1/t12-/m0/s1