4-(4-methoxyphenyl)sulfonyl-1-propan-2-yl-piperidin-1-ium-1-carboxylic acid

Systemtic Name: 4-(4-methoxyphenyl)sulfonyl-1-propan-2-yl-piperidin-1-ium-1-carboxylic acid Openeye Name: 1-isopropyl-4-(4-methoxyphenyl)sulfonyl-piperidin-1-ium-1-carboxylic acid CAS Name: 4-(4-methoxyphenyl)sulfonyl-1-propan-2-yl-1-piperidin-1-iumcarboxylic acid IUPAC Name: 4-(4-methoxyphenyl)sulfonyl-1-propan-2-ylpiperidin-1-ium-1-carboxylic acid Traditional Name: 1-isopropyl-4-(4-methoxyphenyl)sulfonyl-piperidin-1-ium-1-carboxylic acid Formula: C16H24NO5S+ MolecularWeight: 342.43046

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[N+]1(CCC(CC1)S(=O)(=O)C2=CC=C(C=C2)OC)C(=O)O

Isomeric SMILES

CC(C)[N+]1(CCC(CC1)S(=O)(=O)C2=CC=C(C=C2)OC)C(=O)O

InChI

InChI=1S/C16H23NO5S/c1-12(2)17(16(18)19)10-8-15(9-11-17)23(20,21)14-6-4-13(22-3)5-7-14/h4-7,12,15H,8-11H2,1-3H3/p+1