(2S)-2-methyl-1-piperazin-4-ium-1-ylsulfonyl-2,3-dihydroindole

Systemtic Name: (2S)-2-methyl-1-piperazin-4-ium-1-ylsulfonyl-2,3-dihydroindole Openeye Name: (2S)-2-methyl-1-piperazin-4-ium-1-ylsulfonyl-indoline CAS Name: (2S)-2-methyl-1-(1-piperazin-4-iumylsulfonyl)-2,3-dihydroindole IUPAC Name: (2S)-2-methyl-1-piperazin-4-ium-1-ylsulfonyl-2,3-dihydroindole Traditional Name: (2S)-2-methyl-1-piperazin-4-ium-1-ylsulfonyl-indoline Formula: C13H20N3O2S+ MolecularWeight: 282.3818

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=CC=CC=C2N1S(=O)(=O)N3CC[NH2+]CC3

Isomeric SMILES

C[C@H]1CC2=CC=CC=C2N1S(=O)(=O)N3CC[NH2+]CC3

InChI

InChI=1S/C13H19N3O2S/c1-11-10-12-4-2-3-5-13(12)16(11)19(17,18)15-8-6-14-7-9-15/h2-5,11,14H,6-10H2,1H3/p+1/t11-/m0/s1