[4-(4-bromanyl-3-methyl-phenyl)piperidin-1-yl]sulfonyl 2-methylpropanoate

Systemtic Name: [4-(4-bromanyl-3-methyl-phenyl)piperidin-1-yl]sulfonyl 2-methylpropanoate Openeye Name: [4-(4-bromo-3-methyl-phenyl)-1-piperidyl]sulfonyl 2-methylpropanoate CAS Name: 2-methylpropanoic acid [4-(4-bromo-3-methylphenyl)-1-piperidinyl]sulfonyl ester IUPAC Name: [4-(4-bromo-3-methylphenyl)piperidin-1-yl]sulfonyl 2-methylpropanoate Traditional Name: 2-methylpropionic acid [4-(4-bromo-3-methyl-phenyl)piperidino]sulfonyl ester Formula: C16H22BrNO4S MolecularWeight: 404.31918

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22BrNO4S/c1-11(2)16(19)22-23(20,21)18-8-6-13(7-9-18)14-4-5-15(17)12(3)10-14/h4-5,10-11,13H,6-9H2,1-3H3