(2-methoxyphenyl) 4-bromanyl-3-piperidin-1-ylsulfonyl-benzoate

Systemtic Name: (2-methoxyphenyl) 4-bromanyl-3-piperidin-1-ylsulfonyl-benzoate Openeye Name: (2-methoxyphenyl) 4-bromo-3-(1-piperidylsulfonyl)benzoate CAS Name: 4-bromo-3-(1-piperidinylsulfonyl)benzoic acid (2-methoxyphenyl) ester IUPAC Name: (2-methoxyphenyl) 4-bromo-3-piperidin-1-ylsulfonylbenzoate Traditional Name: 4-bromo-3-piperidinosulfonyl-benzoic acid (2-methoxyphenyl) ester Formula: C19H20BrNO5S MolecularWeight: 454.3348

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1OC(=O)C2=CC(=C(C=C2)Br)S(=O)(=O)N3CCCCC3

Isomeric SMILES

COC1=CC=CC=C1OC(=O)C2=CC(=C(C=C2)Br)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C19H20BrNO5S/c1-25-16-7-3-4-8-17(16)26-19(22)14-9-10-15(20)18(13-14)27(23,24)21-11-5-2-6-12-21/h3-4,7-10,13H,2,5-6,11-12H2,1H3