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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OC(=O)C2=CC(=C(C=C2)Br)S(=O)(=O)N3CCCCC3

Isomeric SMILES

COC1=CC=C(C=C1)OC(=O)C2=CC(=C(C=C2)Br)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C19H20BrNO5S/c1-25-15-6-8-16(9-7-15)26-19(22)14-5-10-17(20)18(13-14)27(23,24)21-11-3-2-4-12-21/h5-10,13H,2-4,11-12H2,1H3