(2-benzamido-2-oxidanylidene-ethyl) 3-piperidin-1-ylsulfonylbenzoate

Systemtic Name: (2-benzamido-2-oxidanylidene-ethyl) 3-piperidin-1-ylsulfonylbenzoate Openeye Name: (2-benzamido-2-oxo-ethyl) 3-(1-piperidylsulfonyl)benzoate CAS Name: 3-(1-piperidinylsulfonyl)benzoic acid (2-benzamido-2-oxoethyl) ester IUPAC Name: (2-benzamido-2-oxoethyl) 3-piperidin-1-ylsulfonylbenzoate Traditional Name: 3-piperidinosulfonylbenzoic acid (2-benzamido-2-keto-ethyl) ester Formula: C21H22N2O6S MolecularWeight: 430.47418

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)OCC(=O)NC(=O)C3=CC=CC=C3

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)OCC(=O)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H22N2O6S/c24-19(22-20(25)16-8-3-1-4-9-16)15-29-21(26)17-10-7-11-18(14-17)30(27,28)23-12-5-2-6-13-23/h1,3-4,7-11,14H,2,5-6,12-13,15H2,(H,22,24,25)