[2-oxidanylidene-2-(prop-2-ynylamino)ethyl] (2R)-2-(4-nitrophenyl)sulfonylpropanoate

Systemtic Name: [2-oxidanylidene-2-(prop-2-ynylamino)ethyl] (2R)-2-(4-nitrophenyl)sulfonylpropanoate Openeye Name: [2-oxo-2-(prop-2-ynylamino)ethyl] (2R)-2-(4-nitrophenyl)sulfonylpropanoate CAS Name: (2R)-2-(4-nitrophenyl)sulfonylpropanoic acid [2-oxo-2-(prop-2-ynylamino)ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-ynylamino)ethyl] (2R)-2-(4-nitrophenyl)sulfonylpropanoate Traditional Name: (2R)-2-nosylpropionic acid [2-keto-2-(propargylamino)ethyl] ester Formula: C14H14N2O7S MolecularWeight: 354.33516

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC(=O)NCC#C)S(=O)(=O)C1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

C[C@H](C(=O)OCC(=O)NCC#C)S(=O)(=O)C1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C14H14N2O7S/c1-3-8-15-13(17)9-23-14(18)10(2)24(21,22)12-6-4-11(5-7-12)16(19)20/h1,4-7,10H,8-9H2,2H3,(H,15,17)/t10-/m1/s1