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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCC2=CC=CC=C21)[NH+]3CCN(CC3)C4=CC=C(C=C4)OC

Isomeric SMILES

C[C@H](C(=O)N1CCC2=CC=CC=C21)[NH+]3CCN(CC3)C4=CC=C(C=C4)OC

InChI

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