2,2-dimethyl-1-[(3S)-3-methylpiperidin-1-yl]-3-piperazin-4-ium-1-ylsulfonyl-propan-1-one

Systemtic Name: 2,2-dimethyl-1-[(3S)-3-methylpiperidin-1-yl]-3-piperazin-4-ium-1-ylsulfonyl-propan-1-one Openeye Name: 2,2-dimethyl-1-[(3S)-3-methyl-1-piperidyl]-3-piperazin-4-ium-1-ylsulfonyl-propan-1-one CAS Name: 2,2-dimethyl-1-[(3S)-3-methyl-1-piperidinyl]-3-(1-piperazin-4-iumylsulfonyl)-1-propanone IUPAC Name: 2,2-dimethyl-1-[(3S)-3-methylpiperidin-1-yl]-3-piperazin-4-ium-1-ylsulfonylpropan-1-one Traditional Name: 2,2-dimethyl-1-[(3S)-3-methylpiperidino]-3-piperazin-4-ium-1-ylsulfonyl-propan-1-one Formula: C15H30N3O3S+ MolecularWeight: 332.482

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C(=O)C(C)(C)CS(=O)(=O)N2CC[NH2+]CC2

Isomeric SMILES

C[C@H]1CCCN(C1)C(=O)C(C)(C)CS(=O)(=O)N2CC[NH2+]CC2

InChI

InChI=1S/C15H29N3O3S/c1-13-5-4-8-17(11-13)14(19)15(2,3)12-22(20,21)18-9-6-16-7-10-18/h13,16H,4-12H2,1-3H3/p+1/t13-/m0/s1