methyl 2-[4-[4-(3-ethoxyphenyl)-3-methyl-phenyl]piperidin-1-yl]sulfonyl-2-methyl-propanoate

Systemtic Name: methyl 2-[4-[4-(3-ethoxyphenyl)-3-methyl-phenyl]piperidin-1-yl]sulfonyl-2-methyl-propanoate Openeye Name: methyl 2-[[4-[4-(3-ethoxyphenyl)-3-methyl-phenyl]-1-piperidyl]sulfonyl]-2-methyl-propanoate CAS Name: 2-[[4-[4-(3-ethoxyphenyl)-3-methylphenyl]-1-piperidinyl]sulfonyl]-2-methylpropanoic acid methyl ester IUPAC Name: methyl 2-[4-[4-(3-ethoxyphenyl)-3-methylphenyl]piperidin-1-yl]sulfonyl-2-methylpropanoate Traditional Name: 2-methyl-2-[4-(3-methyl-4-m-phenetyl-phenyl)piperidino]sulfonyl-propionic acid methyl ester Formula: C25H33NO5S MolecularWeight: 459.59822

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)C2=C(C=C(C=C2)C3CCN(CC3)S(=O)(=O)C(C)(C)C(=O)OC)C

Isomeric SMILES

CCOC1=CC=CC(=C1)C2=C(C=C(C=C2)C3CCN(CC3)S(=O)(=O)C(C)(C)C(=O)OC)C

InChI

InChI=1S/C25H33NO5S/c1-6-31-22-9-7-8-21(17-22)23-11-10-20(16-18(23)2)19-12-14-26(15-13-19)32(28,29)25(3,4)24(27)30-5/h7-11,16-17,19H,6,12-15H2,1-5H3