4-(2-methoxyphenyl)-1-(4-methylphenyl)sulfonyl-piperidine-4-carboxylic acid

Systemtic Name: 4-(2-methoxyphenyl)-1-(4-methylphenyl)sulfonyl-piperidine-4-carboxylic acid Openeye Name: 4-(2-methoxyphenyl)-1-(p-tolylsulfonyl)piperidine-4-carboxylic acid CAS Name: 4-(2-methoxyphenyl)-1-(4-methylphenyl)sulfonyl-4-piperidinecarboxylic acid IUPAC Name: 4-(2-methoxyphenyl)-1-(4-methylphenyl)sulfonylpiperidine-4-carboxylic acid Traditional Name: 4-(2-methoxyphenyl)-1-tosyl-isonipecotic acid Formula: C20H23NO5S MolecularWeight: 389.46532

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)(C3=CC=CC=C3OC)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)(C3=CC=CC=C3OC)C(=O)O

InChI

InChI=1S/C20H23NO5S/c1-15-7-9-16(10-8-15)27(24,25)21-13-11-20(12-14-21,19(22)23)17-5-3-4-6-18(17)26-2/h3-10H,11-14H2,1-2H3,(H,22,23)