[(2R)-1-(methoxycarbonylamino)-1-oxidanylidene-propan-2-yl] 2-piperidin-1-ylsulfonylbenzoate

Systemtic Name: [(2R)-1-(methoxycarbonylamino)-1-oxidanylidene-propan-2-yl] 2-piperidin-1-ylsulfonylbenzoate Openeye Name: [(1R)-2-(methoxycarbonylamino)-1-methyl-2-oxo-ethyl] 2-(1-piperidylsulfonyl)benzoate CAS Name: 2-(1-piperidinylsulfonyl)benzoic acid [(2R)-1-(methoxycarbonylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(methoxycarbonylamino)-1-oxopropan-2-yl] 2-piperidin-1-ylsulfonylbenzoate Traditional Name: 2-piperidinosulfonylbenzoic acid [(1R)-2-(carbomethoxyamino)-2-keto-1-methyl-ethyl] ester Formula: C17H22N2O7S MolecularWeight: 398.43078

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)OC)OC(=O)C1=CC=CC=C1S(=O)(=O)N2CCCCC2

Isomeric SMILES

C[C@H](C(=O)NC(=O)OC)OC(=O)C1=CC=CC=C1S(=O)(=O)N2CCCCC2

InChI

InChI=1S/C17H22N2O7S/c1-12(15(20)18-17(22)25-2)26-16(21)13-8-4-5-9-14(13)27(23,24)19-10-6-3-7-11-19/h4-5,8-9,12H,3,6-7,10-11H2,1-2H3,(H,18,20,22)/t12-/m1/s1