8-[3-[[4-methyl-2-(piperidin-1-ylmethyl)phenoxy]methyl]phenyl]-6-(2-methylsulfonylpropan-2-yl)quinoline

Systemtic Name: 8-[3-[[4-methyl-2-(piperidin-1-ylmethyl)phenoxy]methyl]phenyl]-6-(2-methylsulfonylpropan-2-yl)quinoline Openeye Name: 6-(1-methyl-1-methylsulfonyl-ethyl)-8-[3-[[4-methyl-2-(1-piperidylmethyl)phenoxy]methyl]phenyl]quinoline CAS Name: 8-[3-[[4-methyl-2-(1-piperidinylmethyl)phenoxy]methyl]phenyl]-6-(2-methylsulfonylpropan-2-yl)quinoline IUPAC Name: 8-[3-[[4-methyl-2-(piperidin-1-ylmethyl)phenoxy]methyl]phenyl]-6-(2-methylsulfonylpropan-2-yl)quinoline Traditional Name: 6-(1-mesyl-1-methyl-ethyl)-8-[3-[[4-methyl-2-(piperidinomethyl)phenoxy]methyl]phenyl]quinoline Formula: C33H38N2O3S MolecularWeight: 542.73142

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCC2=CC=CC(=C2)C3=C4C(=CC(=C3)C(C)(C)S(=O)(=O)C)C=CC=N4)CN5CCCCC5

Isomeric SMILES

CC1=CC(=C(C=C1)OCC2=CC=CC(=C2)C3=C4C(=CC(=C3)C(C)(C)S(=O)(=O)C)C=CC=N4)CN5CCCCC5

InChI

InChI=1S/C33H38N2O3S/c1-24-13-14-31(28(18-24)22-35-16-6-5-7-17-35)38-23-25-10-8-11-26(19-25)30-21-29(33(2,3)39(4,36)37)20-27-12-9-15-34-32(27)30/h8-15,18-21H,5-7,16-17,22-23H2,1-4H3