methyl 4-[4-[4-[3-(dimethylaminomethyl)phenyl]-3-methyl-phenyl]piperidin-1-yl]sulfonyloxane-4-carboxylate

Systemtic Name: methyl 4-[4-[4-[3-(dimethylaminomethyl)phenyl]-3-methyl-phenyl]piperidin-1-yl]sulfonyloxane-4-carboxylate Openeye Name: methyl 4-[[4-[4-[3-(dimethylaminomethyl)phenyl]-3-methyl-phenyl]-1-piperidyl]sulfonyl]tetrahydropyran-4-carboxylate CAS Name: 4-[[4-[4-[3-(dimethylaminomethyl)phenyl]-3-methylphenyl]-1-piperidinyl]sulfonyl]-4-oxanecarboxylic acid methyl ester IUPAC Name: methyl 4-[4-[4-[3-(dimethylaminomethyl)phenyl]-3-methylphenyl]piperidin-1-yl]sulfonyloxane-4-carboxylate Traditional Name: 4-[4-[4-[3-(dimethylaminomethyl)phenyl]-3-methyl-phenyl]piperidino]sulfonyltetrahydropyran-4-carboxylic acid methyl ester Formula: C28H38N2O5S MolecularWeight: 514.67672

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2CCN(CC2)S(=O)(=O)C3(CCOCC3)C(=O)OC)C4=CC(=CC=C4)CN(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)C2CCN(CC2)S(=O)(=O)C3(CCOCC3)C(=O)OC)C4=CC(=CC=C4)CN(C)C

InChI

InChI=1S/C28H38N2O5S/c1-21-18-24(8-9-26(21)25-7-5-6-22(19-25)20-29(2)3)23-10-14-30(15-11-23)36(32,33)28(27(31)34-4)12-16-35-17-13-28/h5-9,18-19,23H,10-17,20H2,1-4H3