[4-(4-bromanyl-3-methyl-phenyl)-3,6-dihydro-2H-pyridin-1-yl]sulfonyl ethanoate

Systemtic Name: [4-(4-bromanyl-3-methyl-phenyl)-3,6-dihydro-2H-pyridin-1-yl]sulfonyl ethanoate Openeye Name: [4-(4-bromo-3-methyl-phenyl)-3,6-dihydro-2H-pyridin-1-yl]sulfonyl acetate CAS Name: acetic acid [4-(4-bromo-3-methylphenyl)-3,6-dihydro-2H-pyridin-1-yl]sulfonyl ester IUPAC Name: [4-(4-bromo-3-methylphenyl)-3,6-dihydro-2H-pyridin-1-yl]sulfonyl acetate Traditional Name: acetic acid [4-(4-bromo-3-methyl-phenyl)-3,6-dihydro-2H-pyridin-1-yl]sulfonyl ester Formula: C14H16BrNO4S MolecularWeight: 374.25014

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2=CCN(CC2)S(=O)(=O)OC(=O)C)Br

Isomeric SMILES

CC1=C(C=CC(=C1)C2=CCN(CC2)S(=O)(=O)OC(=O)C)Br

InChI

InChI=1S/C14H16BrNO4S/c1-10-9-13(3-4-14(10)15)12-5-7-16(8-6-12)21(18,19)20-11(2)17/h3-5,9H,6-8H2,1-2H3