4-(4-bromanyl-3-methyl-phenyl)-1-methylsulfonyl-piperidine

Systemtic Name: 4-(4-bromanyl-3-methyl-phenyl)-1-methylsulfonyl-piperidine Openeye Name: 4-(4-bromo-3-methyl-phenyl)-1-methylsulfonyl-piperidine CAS Name: 4-(4-bromo-3-methylphenyl)-1-methylsulfonylpiperidine IUPAC Name: 4-(4-bromo-3-methylphenyl)-1-methylsulfonylpiperidine Traditional Name: 4-(4-bromo-3-methyl-phenyl)-1-mesyl-piperidine Formula: C13H18BrNO2S MolecularWeight: 332.25652

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2CCN(CC2)S(=O)(=O)C)Br

Isomeric SMILES

CC1=C(C=CC(=C1)C2CCN(CC2)S(=O)(=O)C)Br

InChI

InChI=1S/C13H18BrNO2S/c1-10-9-12(3-4-13(10)14)11-5-7-15(8-6-11)18(2,16)17/h3-4,9,11H,5-8H2,1-2H3