1-(4-ethoxy-3-methyl-phenyl)sulfonylpiperidine-4-carboxylic acid

Systemtic Name: 1-(4-ethoxy-3-methyl-phenyl)sulfonylpiperidine-4-carboxylic acid Openeye Name: 1-(4-ethoxy-3-methyl-phenyl)sulfonylpiperidine-4-carboxylic acid CAS Name: 1-(4-ethoxy-3-methylphenyl)sulfonyl-4-piperidinecarboxylic acid IUPAC Name: 1-(4-ethoxy-3-methylphenyl)sulfonylpiperidine-4-carboxylic acid Traditional Name: 1-(4-ethoxy-3-methyl-phenyl)sulfonylisonipecotic acid Formula: C15H21NO5S MolecularWeight: 327.39594

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)O)C

Isomeric SMILES

CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)O)C

InChI

InChI=1S/C15H21NO5S/c1-3-21-14-5-4-13(10-11(14)2)22(19,20)16-8-6-12(7-9-16)15(17)18/h4-5,10,12H,3,6-9H2,1-2H3,(H,17,18)