methyl 2-bromanyl-5-(4-methoxypiperidin-1-yl)sulfonyl-benzoate

Systemtic Name: methyl 2-bromanyl-5-(4-methoxypiperidin-1-yl)sulfonyl-benzoate Openeye Name: methyl 2-bromo-5-[(4-methoxy-1-piperidyl)sulfonyl]benzoate CAS Name: 2-bromo-5-[(4-methoxy-1-piperidinyl)sulfonyl]benzoic acid methyl ester IUPAC Name: methyl 2-bromo-5-(4-methoxypiperidin-1-yl)sulfonylbenzoate Traditional Name: 2-bromo-5-(4-methoxypiperidino)sulfonyl-benzoic acid methyl ester Formula: C14H18BrNO5S MolecularWeight: 392.26542

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Descriptors Computed from Structure

Canonical SMILES:

COC1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Br)C(=O)OC

Isomeric SMILES

COC1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Br)C(=O)OC

InChI

InChI=1S/C14H18BrNO5S/c1-20-10-5-7-16(8-6-10)22(18,19)11-3-4-13(15)12(9-11)14(17)21-2/h3-4,9-10H,5-8H2,1-2H3