(3S)-1-(2-bromanyl-5-methoxy-phenyl)sulfonyl-3-methyl-piperidine

Systemtic Name: (3S)-1-(2-bromanyl-5-methoxy-phenyl)sulfonyl-3-methyl-piperidine Openeye Name: (3S)-1-(2-bromo-5-methoxy-phenyl)sulfonyl-3-methyl-piperidine CAS Name: (3S)-1-(2-bromo-5-methoxyphenyl)sulfonyl-3-methylpiperidine IUPAC Name: (3S)-1-(2-bromo-5-methoxyphenyl)sulfonyl-3-methylpiperidine Traditional Name: (3S)-1-(2-bromo-5-methoxy-phenyl)sulfonyl-3-methyl-piperidine Formula: C13H18BrNO3S MolecularWeight: 348.25592

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=C(C=CC(=C2)OC)Br

Isomeric SMILES

C[C@H]1CCCN(C1)S(=O)(=O)C2=C(C=CC(=C2)OC)Br

InChI

InChI=1S/C13H18BrNO3S/c1-10-4-3-7-15(9-10)19(16,17)13-8-11(18-2)5-6-12(13)14/h5-6,8,10H,3-4,7,9H2,1-2H3/t10-/m0/s1