[4-(4-bromanyl-3-methyl-phenyl)piperidin-1-yl]sulfonyl oxane-4-carboxylate

Systemtic Name: [4-(4-bromanyl-3-methyl-phenyl)piperidin-1-yl]sulfonyl oxane-4-carboxylate Openeye Name: [4-(4-bromo-3-methyl-phenyl)-1-piperidyl]sulfonyl tetrahydropyran-4-carboxylate CAS Name: 4-oxanecarboxylic acid [4-(4-bromo-3-methylphenyl)-1-piperidinyl]sulfonyl ester IUPAC Name: [4-(4-bromo-3-methylphenyl)piperidin-1-yl]sulfonyl oxane-4-carboxylate Traditional Name: tetrahydropyran-4-carboxylic acid [4-(4-bromo-3-methyl-phenyl)piperidino]sulfonyl ester Formula: C18H24BrNO5S MolecularWeight: 446.35586

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2CCN(CC2)S(=O)(=O)OC(=O)C3CCOCC3)Br

Isomeric SMILES

CC1=C(C=CC(=C1)C2CCN(CC2)S(=O)(=O)OC(=O)C3CCOCC3)Br

InChI

InChI=1S/C18H24BrNO5S/c1-13-12-16(2-3-17(13)19)14-4-8-20(9-5-14)26(22,23)25-18(21)15-6-10-24-11-7-15/h2-3,12,14-15H,4-11H2,1H3