4-[[1-(phenylsulfonyl)piperidin-4-yl]carbonylamino]benzoate

Systemtic Name: 4-[[1-(phenylsulfonyl)piperidin-4-yl]carbonylamino]benzoate Openeye Name: 4-[[1-(benzenesulfonyl)piperidine-4-carbonyl]amino]benzoate CAS Name: 4-[[[1-(benzenesulfonyl)-4-piperidinyl]-oxomethyl]amino]benzoate IUPAC Name: 4-[[1-(benzenesulfonyl)piperidine-4-carbonyl]amino]benzoate Traditional Name: 4-[(1-besylisonipecotoyl)amino]benzoate Formula: C19H19N2O5S- MolecularWeight: 387.42956

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC=C(C=C2)C(=O)[O-])S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC=C(C=C2)C(=O)[O-])S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C19H20N2O5S/c22-18(20-16-8-6-15(7-9-16)19(23)24)14-10-12-21(13-11-14)27(25,26)17-4-2-1-3-5-17/h1-9,14H,10-13H2,(H,20,22)(H,23,24)/p-1