3-[[4-[3,5-dimethyl-4-(piperidin-3-ylmethoxy)phenyl]sulfonyl-2,6-dimethyl-phenoxy]methyl]piperidine

Systemtic Name: 3-[[4-[3,5-dimethyl-4-(piperidin-3-ylmethoxy)phenyl]sulfonyl-2,6-dimethyl-phenoxy]methyl]piperidine Openeye Name: 3-[[4-[3,5-dimethyl-4-(3-piperidylmethoxy)phenyl]sulfonyl-2,6-dimethyl-phenoxy]methyl]piperidine CAS Name: 3-[[4-[3,5-dimethyl-4-(3-piperidinylmethoxy)phenyl]sulfonyl-2,6-dimethylphenoxy]methyl]piperidine IUPAC Name: 3-[[4-[3,5-dimethyl-4-(piperidin-3-ylmethoxy)phenyl]sulfonyl-2,6-dimethylphenoxy]methyl]piperidine Traditional Name: 3-[[4-[3,5-dimethyl-4-(3-piperidylmethoxy)phenyl]sulfonyl-2,6-dimethyl-phenoxy]methyl]piperidine Formula: C28H40N2O4S MolecularWeight: 500.6932

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCC2CCCNC2)C)S(=O)(=O)C3=CC(=C(C(=C3)C)OCC4CCCNC4)C

Isomeric SMILES

CC1=CC(=CC(=C1OCC2CCCNC2)C)S(=O)(=O)C3=CC(=C(C(=C3)C)OCC4CCCNC4)C

InChI

InChI=1S/C28H40N2O4S/c1-19-11-25(12-20(2)27(19)33-17-23-7-5-9-29-15-23)35(31,32)26-13-21(3)28(22(4)14-26)34-18-24-8-6-10-30-16-24/h11-14,23-24,29-30H,5-10,15-18H2,1-4H3