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

Systemtic Name: methyl 2-methyl-2-[4-[3-methyl-4-[3-(2-methylpropoxy)phenyl]phenyl]piperidin-1-yl]sulfonyl-propanoate Openeye Name: methyl 2-[[4-[4-(3-isobutoxyphenyl)-3-methyl-phenyl]-1-piperidyl]sulfonyl]-2-methyl-propanoate CAS Name: 2-methyl-2-[[4-[3-methyl-4-[3-(2-methylpropoxy)phenyl]phenyl]-1-piperidinyl]sulfonyl]propanoic acid methyl ester IUPAC Name: methyl 2-methyl-2-[4-[3-methyl-4-[3-(2-methylpropoxy)phenyl]phenyl]piperidin-1-yl]sulfonylpropanoate Traditional Name: 2-[4-[4-(3-isobutoxyphenyl)-3-methyl-phenyl]piperidino]sulfonyl-2-methyl-propionic acid methyl ester Formula: C27H37NO5S MolecularWeight: 487.65138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2CCN(CC2)S(=O)(=O)C(C)(C)C(=O)OC)C3=CC(=CC=C3)OCC(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)C2CCN(CC2)S(=O)(=O)C(C)(C)C(=O)OC)C3=CC(=CC=C3)OCC(C)C

InChI

InChI=1S/C27H37NO5S/c1-19(2)18-33-24-9-7-8-23(17-24)25-11-10-22(16-20(25)3)21-12-14-28(15-13-21)34(30,31)27(4,5)26(29)32-6/h7-11,16-17,19,21H,12-15,18H2,1-6H3