4-(4-methoxyphenyl)sulfonyl-1-(naphthalen-2-ylmethyl)piperidine-4-carboxylic acid

Systemtic Name: 4-(4-methoxyphenyl)sulfonyl-1-(naphthalen-2-ylmethyl)piperidine-4-carboxylic acid Openeye Name: 4-(4-methoxyphenyl)sulfonyl-1-(2-naphthylmethyl)piperidine-4-carboxylic acid CAS Name: 4-(4-methoxyphenyl)sulfonyl-1-(2-naphthalenylmethyl)-4-piperidinecarboxylic acid IUPAC Name: 4-(4-methoxyphenyl)sulfonyl-1-(naphthalen-2-ylmethyl)piperidine-4-carboxylic acid Traditional Name: 4-(4-methoxyphenyl)sulfonyl-1-(2-naphthylmethyl)isonipecotic acid Formula: C24H25NO5S MolecularWeight: 439.524

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)C2(CCN(CC2)CC3=CC4=CC=CC=C4C=C3)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)C2(CCN(CC2)CC3=CC4=CC=CC=C4C=C3)C(=O)O

InChI

InChI=1S/C24H25NO5S/c1-30-21-8-10-22(11-9-21)31(28,29)24(23(26)27)12-14-25(15-13-24)17-18-6-7-19-4-2-3-5-20(19)16-18/h2-11,16H,12-15,17H2,1H3,(H,26,27)