ethyl 2-(4-methoxyphenyl)sulfonyl-2-(pyridin-3-ylmethyl)decanoate

Systemtic Name: ethyl 2-(4-methoxyphenyl)sulfonyl-2-(pyridin-3-ylmethyl)decanoate Openeye Name: ethyl 2-(4-methoxyphenyl)sulfonyl-2-(3-pyridylmethyl)decanoate CAS Name: 2-(4-methoxyphenyl)sulfonyl-2-(3-pyridinylmethyl)decanoic acid ethyl ester IUPAC Name: ethyl 2-(4-methoxyphenyl)sulfonyl-2-(pyridin-3-ylmethyl)decanoate Traditional Name: 2-(4-methoxyphenyl)sulfonyl-2-(3-pyridylmethyl)capric acid ethyl ester Formula: C25H35NO5S MolecularWeight: 461.6141

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H35NO5S/c1-4-6-7-8-9-10-17-25(24(27)31-5-2,19-21-12-11-18-26-20-21)32(28,29)23-15-13-22(30-3)14-16-23/h11-16,18,20H,4-10,17,19H2,1-3H3