(2R)-1-(2,3-dihydroindol-1-yl)-2-(4-naphthalen-2-ylsulfonylpiperazin-1-ium-1-yl)propan-1-one

Systemtic Name: (2R)-1-(2,3-dihydroindol-1-yl)-2-(4-naphthalen-2-ylsulfonylpiperazin-1-ium-1-yl)propan-1-one Openeye Name: (2R)-1-indolin-1-yl-2-[4-(2-naphthylsulfonyl)piperazin-1-ium-1-yl]propan-1-one CAS Name: (2R)-1-(2,3-dihydroindol-1-yl)-2-[4-(2-naphthalenylsulfonyl)-1-piperazin-1-iumyl]-1-propanone IUPAC Name: (2R)-1-(2,3-dihydroindol-1-yl)-2-(4-naphthalen-2-ylsulfonylpiperazin-1-ium-1-yl)propan-1-one Traditional Name: (2R)-1-indolin-1-yl-2-[4-(2-naphthylsulfonyl)piperazin-1-ium-1-yl]propan-1-one Formula: C25H28N3O3S+ MolecularWeight: 450.57312

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCC2=CC=CC=C21)[NH+]3CCN(CC3)S(=O)(=O)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

C[C@H](C(=O)N1CCC2=CC=CC=C21)[NH+]3CCN(CC3)S(=O)(=O)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C25H27N3O3S/c1-19(25(29)28-13-12-21-7-4-5-9-24(21)28)26-14-16-27(17-15-26)32(30,31)23-11-10-20-6-2-3-8-22(20)18-23/h2-11,18-19H,12-17H2,1H3/p+1/t19-/m1/s1