(3S)-N-(2-methyl-6-propan-2-yl-phenyl)piperidin-1-ium-3-sulfonamide

Systemtic Name: (3S)-N-(2-methyl-6-propan-2-yl-phenyl)piperidin-1-ium-3-sulfonamide Openeye Name: (3S)-N-(2-isopropyl-6-methyl-phenyl)piperidin-1-ium-3-sulfonamide CAS Name: (3S)-N-(2-methyl-6-propan-2-ylphenyl)-3-piperidin-1-iumsulfonamide IUPAC Name: (3S)-N-(2-methyl-6-propan-2-ylphenyl)piperidin-1-ium-3-sulfonamide Traditional Name: (3S)-N-(2-isopropyl-6-methyl-phenyl)piperidin-1-ium-3-sulfonamide Formula: C15H25N2O2S+ MolecularWeight: 297.4362

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C(C)C)NS(=O)(=O)C2CCC[NH2+]C2

Isomeric SMILES

CC1=C(C(=CC=C1)C(C)C)NS(=O)(=O)[C@H]2CCC[NH2+]C2

InChI

InChI=1S/C15H24N2O2S/c1-11(2)14-8-4-6-12(3)15(14)17-20(18,19)13-7-5-9-16-10-13/h4,6,8,11,13,16-17H,5,7,9-10H2,1-3H3/p+1/t13-/m0/s1