(6-bromanylnaphthalen-2-yl) 4-piperidin-1-ylsulfonylbenzoate

Systemtic Name: (6-bromanylnaphthalen-2-yl) 4-piperidin-1-ylsulfonylbenzoate Openeye Name: (6-bromo-2-naphthyl) 4-(1-piperidylsulfonyl)benzoate CAS Name: 4-(1-piperidinylsulfonyl)benzoic acid (6-bromo-2-naphthalenyl) ester IUPAC Name: (6-bromonaphthalen-2-yl) 4-piperidin-1-ylsulfonylbenzoate Traditional Name: 4-piperidinosulfonylbenzoic acid (6-bromo-2-naphthyl) ester Formula: C22H20BrNO4S MolecularWeight: 474.3675

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OC3=CC4=C(C=C3)C=C(C=C4)Br

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OC3=CC4=C(C=C3)C=C(C=C4)Br

InChI

InChI=1S/C22H20BrNO4S/c23-19-8-4-18-15-20(9-5-17(18)14-19)28-22(25)16-6-10-21(11-7-16)29(26,27)24-12-2-1-3-13-24/h4-11,14-15H,1-3,12-13H2