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

Systemtic Name: 2-[4-(2-chlorophenyl)piperazin-1-ium-1-yl]-1-[(2S)-2-methyl-2,3-dihydroindol-1-yl]ethanone Openeye Name: 2-[4-(2-chlorophenyl)piperazin-1-ium-1-yl]-1-[(2S)-2-methylindolin-1-yl]ethanone CAS Name: 2-[4-(2-chlorophenyl)-1-piperazin-1-iumyl]-1-[(2S)-2-methyl-2,3-dihydroindol-1-yl]ethanone IUPAC Name: 2-[4-(2-chlorophenyl)piperazin-1-ium-1-yl]-1-[(2S)-2-methyl-2,3-dihydroindol-1-yl]ethanone Traditional Name: 2-[4-(2-chlorophenyl)piperazin-1-ium-1-yl]-1-[(2S)-2-methylindolin-1-yl]ethanone Formula: C21H25ClN3O+ MolecularWeight: 370.8957

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=CC=CC=C2N1C(=O)C[NH+]3CCN(CC3)C4=CC=CC=C4Cl

Isomeric SMILES

C[C@H]1CC2=CC=CC=C2N1C(=O)C[NH+]3CCN(CC3)C4=CC=CC=C4Cl

InChI

InChI=1S/C21H24ClN3O/c1-16-14-17-6-2-4-8-19(17)25(16)21(26)15-23-10-12-24(13-11-23)20-9-5-3-7-18(20)22/h2-9,16H,10-15H2,1H3/p+1/t16-/m0/s1