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

Systemtic Name: (2R)-1-(1H-indol-3-yl)-2-[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]propan-1-one Openeye Name: (2R)-1-(1H-indol-3-yl)-2-[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]propan-1-one CAS Name: (2R)-1-(1H-indol-3-yl)-2-[4-(3-methoxyphenyl)-1-piperazin-1-iumyl]-1-propanone IUPAC Name: (2R)-1-(1H-indol-3-yl)-2-[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]propan-1-one Traditional Name: (2R)-1-(1H-indol-3-yl)-2-[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]propan-1-one Formula: C22H26N3O2+ MolecularWeight: 364.46074

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CNC2=CC=CC=C21)[NH+]3CCN(CC3)C4=CC(=CC=C4)OC

Isomeric SMILES

C[C@H](C(=O)C1=CNC2=CC=CC=C21)[NH+]3CCN(CC3)C4=CC(=CC=C4)OC

InChI

InChI=1S/C22H25N3O2/c1-16(22(26)20-15-23-21-9-4-3-8-19(20)21)24-10-12-25(13-11-24)17-6-5-7-18(14-17)27-2/h3-9,14-16,23H,10-13H2,1-2H3/p+1/t16-/m1/s1