(2R)-1-[(3R,5S)-3,5-dimethylpiperidin-1-yl]sulfonyl-2-(4-methoxyphenyl)azepane

Systemtic Name: (2R)-1-[(3R,5S)-3,5-dimethylpiperidin-1-yl]sulfonyl-2-(4-methoxyphenyl)azepane Openeye Name: (2R)-1-[[(3R,5S)-3,5-dimethyl-1-piperidyl]sulfonyl]-2-(4-methoxyphenyl)azepane CAS Name: (2R)-1-[[(3R,5S)-3,5-dimethyl-1-piperidinyl]sulfonyl]-2-(4-methoxyphenyl)azepane IUPAC Name: (2R)-1-[(3R,5S)-3,5-dimethylpiperidin-1-yl]sulfonyl-2-(4-methoxyphenyl)azepane Traditional Name: (2R)-1-[(3R,5S)-3,5-dimethylpiperidino]sulfonyl-2-(4-methoxyphenyl)azepane Formula: C20H32N2O3S MolecularWeight: 380.54468

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)S(=O)(=O)N2CCCCCC2C3=CC=C(C=C3)OC)C

Isomeric SMILES

C[C@@H]1C[C@@H](CN(C1)S(=O)(=O)N2CCCCC[C@@H]2C3=CC=C(C=C3)OC)C

InChI

InChI=1S/C20H32N2O3S/c1-16-13-17(2)15-21(14-16)26(23,24)22-12-6-4-5-7-20(22)18-8-10-19(25-3)11-9-18/h8-11,16-17,20H,4-7,12-15H2,1-3H3/t16-,17+,20-/m1/s1