2-[[4-[4-(3-ethoxyphenyl)-3-methyl-phenyl]-3,6-dihydro-2H-pyridin-1-yl]sulfonyl]-2-methyl-propanoic acid

Systemtic Name: 2-[[4-[4-(3-ethoxyphenyl)-3-methyl-phenyl]-3,6-dihydro-2H-pyridin-1-yl]sulfonyl]-2-methyl-propanoic acid Openeye Name: 2-[[4-[4-(3-ethoxyphenyl)-3-methyl-phenyl]-3,6-dihydro-2H-pyridin-1-yl]sulfonyl]-2-methyl-propanoic acid CAS Name: 2-[[4-[4-(3-ethoxyphenyl)-3-methylphenyl]-3,6-dihydro-2H-pyridin-1-yl]sulfonyl]-2-methylpropanoic acid IUPAC Name: 2-[[4-[4-(3-ethoxyphenyl)-3-methylphenyl]-3,6-dihydro-2H-pyridin-1-yl]sulfonyl]-2-methylpropanoic acid Traditional Name: 2-methyl-2-[[4-(3-methyl-4-m-phenetyl-phenyl)-3,6-dihydro-2H-pyridin-1-yl]sulfonyl]propionic acid Formula: C24H29NO5S MolecularWeight: 443.55576

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)C2=C(C=C(C=C2)C3=CCN(CC3)S(=O)(=O)C(C)(C)C(=O)O)C

Isomeric SMILES

CCOC1=CC=CC(=C1)C2=C(C=C(C=C2)C3=CCN(CC3)S(=O)(=O)C(C)(C)C(=O)O)C

InChI

InChI=1S/C24H29NO5S/c1-5-30-21-8-6-7-20(16-21)22-10-9-19(15-17(22)2)18-11-13-25(14-12-18)31(28,29)24(3,4)23(26)27/h6-11,15-16H,5,12-14H2,1-4H3,(H,26,27)