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

Systemtic Name: 2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]-1-[(2R)-2-methyl-2,3-dihydroindol-1-yl]ethanone Openeye Name: 2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]-1-[(2R)-2-methylindolin-1-yl]ethanone CAS Name: 2-[4-(4-methoxyphenyl)-1-piperazin-1-iumyl]-1-[(2R)-2-methyl-2,3-dihydroindol-1-yl]ethanone IUPAC Name: 2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]-1-[(2R)-2-methyl-2,3-dihydroindol-1-yl]ethanone Traditional Name: 2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]-1-[(2R)-2-methylindolin-1-yl]ethanone Formula: C22H28N3O2+ MolecularWeight: 366.47662

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27N3O2/c1-17-15-18-5-3-4-6-21(18)25(17)22(26)16-23-11-13-24(14-12-23)19-7-9-20(27-2)10-8-19/h3-10,17H,11-16H2,1-2H3/p+1/t17-/m1/s1