(2-chlorophenyl)sulfonyl-[4-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]phenyl]azanide

Systemtic Name: (2-chlorophenyl)sulfonyl-[4-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]phenyl]azanide Openeye Name: (2-chlorophenyl)sulfonyl-[4-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]phenyl]azanide CAS Name: (2-chlorophenyl)sulfonyl-[4-[[(3S)-3-methyl-1-piperidin-1-iumyl]methyl]phenyl]azanide IUPAC Name: (2-chlorophenyl)sulfonyl-[4-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]phenyl]azanide Traditional Name: (2-chlorophenyl)sulfonyl-[4-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]phenyl]azanide Formula: C19H23ClN2O2S MolecularWeight: 378.91612

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CC2=CC=C(C=C2)[N-]S(=O)(=O)C3=CC=CC=C3Cl

Isomeric SMILES

C[C@H]1CCC[NH+](C1)CC2=CC=C(C=C2)[N-]S(=O)(=O)C3=CC=CC=C3Cl

InChI

InChI=1S/C19H22ClN2O2S/c1-15-5-4-12-22(13-15)14-16-8-10-17(11-9-16)21-25(23,24)19-7-3-2-6-18(19)20/h2-3,6-11,15H,4-5,12-14H2,1H3/q-1/p+1/t15-/m0/s1