2-(4-methoxyphenyl)sulfonyl-2-(pyridin-3-ylmethyl)decanoic acid

Systemtic Name: 2-(4-methoxyphenyl)sulfonyl-2-(pyridin-3-ylmethyl)decanoic acid Openeye Name: 2-(4-methoxyphenyl)sulfonyl-2-(3-pyridylmethyl)decanoic acid CAS Name: 2-(4-methoxyphenyl)sulfonyl-2-(3-pyridinylmethyl)decanoic acid IUPAC Name: 2-(4-methoxyphenyl)sulfonyl-2-(pyridin-3-ylmethyl)decanoic acid Traditional Name: 2-(4-methoxyphenyl)sulfonyl-2-(3-pyridylmethyl)capric acid Formula: C23H31NO5S MolecularWeight: 433.56094

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(CC1=CN=CC=C1)(C(=O)O)S(=O)(=O)C2=CC=C(C=C2)OC

Isomeric SMILES

CCCCCCCCC(CC1=CN=CC=C1)(C(=O)O)S(=O)(=O)C2=CC=C(C=C2)OC

InChI

InChI=1S/C23H31NO5S/c1-3-4-5-6-7-8-15-23(22(25)26,17-19-10-9-16-24-18-19)30(27,28)21-13-11-20(29-2)12-14-21/h9-14,16,18H,3-8,15,17H2,1-2H3,(H,25,26)