(3S,5S)-3,5-dimethyl-1-(3-propan-2-yl-4-propoxy-phenyl)sulfonyl-piperidine

Systemtic Name: (3S,5S)-3,5-dimethyl-1-(3-propan-2-yl-4-propoxy-phenyl)sulfonyl-piperidine Openeye Name: (3S,5S)-1-(3-isopropyl-4-propoxy-phenyl)sulfonyl-3,5-dimethyl-piperidine CAS Name: (3S,5S)-3,5-dimethyl-1-(3-propan-2-yl-4-propoxyphenyl)sulfonylpiperidine IUPAC Name: (3S,5S)-3,5-dimethyl-1-(3-propan-2-yl-4-propoxyphenyl)sulfonylpiperidine Traditional Name: (3S,5S)-1-(3-isopropyl-4-propoxy-phenyl)sulfonyl-3,5-dimethyl-piperidine Formula: C19H31NO3S MolecularWeight: 353.51934

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)S(=O)(=O)N2CC(CC(C2)C)C)C(C)C

Isomeric SMILES

CCCOC1=C(C=C(C=C1)S(=O)(=O)N2C[C@H](C[C@@H](C2)C)C)C(C)C

InChI

InChI=1S/C19H31NO3S/c1-6-9-23-19-8-7-17(11-18(19)14(2)3)24(21,22)20-12-15(4)10-16(5)13-20/h7-8,11,14-16H,6,9-10,12-13H2,1-5H3/t15-,16-/m0/s1