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

Systemtic Name: 2-(2,3-dihydroindol-1-yl)-1-[4-[(2-methylphenyl)methyl]piperazin-4-ium-1-yl]ethanone Openeye Name: 2-indolin-1-yl-1-[4-(o-tolylmethyl)piperazin-4-ium-1-yl]ethanone CAS Name: 2-(2,3-dihydroindol-1-yl)-1-[4-[(2-methylphenyl)methyl]-1-piperazin-4-iumyl]ethanone IUPAC Name: 2-(2,3-dihydroindol-1-yl)-1-[4-[(2-methylphenyl)methyl]piperazin-4-ium-1-yl]ethanone Traditional Name: 2-indolin-1-yl-1-[4-(2-methylbenzyl)piperazin-4-ium-1-yl]ethanone Formula: C22H28N3O+ MolecularWeight: 350.47722

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C[NH+]2CCN(CC2)C(=O)CN3CCC4=CC=CC=C43

Isomeric SMILES

CC1=CC=CC=C1C[NH+]2CCN(CC2)C(=O)CN3CCC4=CC=CC=C43

InChI

InChI=1S/C22H27N3O/c1-18-6-2-3-8-20(18)16-23-12-14-24(15-13-23)22(26)17-25-11-10-19-7-4-5-9-21(19)25/h2-9H,10-17H2,1H3/p+1