(2S,6S)-2,6-dimethyl-1-[4-[(3S)-3-methylpiperidin-1-yl]sulfonylphenyl]sulfonyl-piperidine

Systemtic Name: (2S,6S)-2,6-dimethyl-1-[4-[(3S)-3-methylpiperidin-1-yl]sulfonylphenyl]sulfonyl-piperidine Openeye Name: (2S,6S)-2,6-dimethyl-1-[4-[[(3S)-3-methyl-1-piperidyl]sulfonyl]phenyl]sulfonyl-piperidine CAS Name: (2S,6S)-2,6-dimethyl-1-[4-[[(3S)-3-methyl-1-piperidinyl]sulfonyl]phenyl]sulfonylpiperidine IUPAC Name: (2S,6S)-2,6-dimethyl-1-[4-[(3S)-3-methylpiperidin-1-yl]sulfonylphenyl]sulfonylpiperidine Traditional Name: (2S,6S)-2,6-dimethyl-1-[4-[(3S)-3-methylpiperidino]sulfonylphenyl]sulfonyl-piperidine Formula: C19H30N2O4S2 MolecularWeight: 414.5825

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3C(CCCC3C)C

Isomeric SMILES

C[C@H]1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3[C@H](CCC[C@@H]3C)C

InChI

InChI=1S/C19H30N2O4S2/c1-15-6-5-13-20(14-15)26(22,23)18-9-11-19(12-10-18)27(24,25)21-16(2)7-4-8-17(21)3/h9-12,15-17H,4-8,13-14H2,1-3H3/t15-,16-,17-/m0/s1