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

Systemtic Name: methyl 2-[4-[4-[3-(2-dimethylaminoethyloxy)phenyl]-3-methyl-phenyl]piperidin-1-yl]sulfonyl-2-methyl-propanoate Openeye Name: methyl 2-[[4-[4-[3-(2-dimethylaminoethyloxy)phenyl]-3-methyl-phenyl]-1-piperidyl]sulfonyl]-2-methyl-propanoate CAS Name: 2-[[4-[4-[3-(2-dimethylaminoethyloxy)phenyl]-3-methylphenyl]-1-piperidinyl]sulfonyl]-2-methylpropanoic acid methyl ester IUPAC Name: methyl 2-[4-[4-[3-(2-dimethylaminoethyloxy)phenyl]-3-methylphenyl]piperidin-1-yl]sulfonyl-2-methylpropanoate Traditional Name: 2-[4-[4-[3-(2-dimethylaminoethyloxy)phenyl]-3-methyl-phenyl]piperidino]sulfonyl-2-methyl-propionic acid methyl ester Formula: C27H38N2O5S MolecularWeight: 502.66602

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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)OCCN(C)C

Isomeric SMILES

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

InChI

InChI=1S/C27H38N2O5S/c1-20-18-22(10-11-25(20)23-8-7-9-24(19-23)34-17-16-28(4)5)21-12-14-29(15-13-21)35(31,32)27(2,3)26(30)33-6/h7-11,18-19,21H,12-17H2,1-6H3