(1-azanyl-1-oxidanylidene-propan-2-yl) 1-(3-ethanoylphenyl)sulfonylpiperidine-4-carboxylate

Systemtic Name: (1-azanyl-1-oxidanylidene-propan-2-yl) 1-(3-ethanoylphenyl)sulfonylpiperidine-4-carboxylate Openeye Name: (2-amino-1-methyl-2-oxo-ethyl) 1-(3-acetylphenyl)sulfonylpiperidine-4-carboxylate CAS Name: 1-(3-acetylphenyl)sulfonyl-4-piperidinecarboxylic acid (1-amino-1-oxopropan-2-yl) ester IUPAC Name: (1-amino-1-oxopropan-2-yl) 1-(3-acetylphenyl)sulfonylpiperidine-4-carboxylate Traditional Name: 1-(3-acetylphenyl)sulfonylisonipecotic acid (2-amino-2-keto-1-methyl-ethyl) ester Formula: C17H22N2O6S MolecularWeight: 382.43138

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N)OC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)C

Isomeric SMILES

CC(C(=O)N)OC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)C

InChI

InChI=1S/C17H22N2O6S/c1-11(20)14-4-3-5-15(10-14)26(23,24)19-8-6-13(7-9-19)17(22)25-12(2)16(18)21/h3-5,10,12-13H,6-9H2,1-2H3,(H2,18,21)