[2-oxidanylidene-2-(propylamino)ethyl] (2S)-2-(4-nitrophenyl)sulfonylpropanoate

Systemtic Name: [2-oxidanylidene-2-(propylamino)ethyl] (2S)-2-(4-nitrophenyl)sulfonylpropanoate Openeye Name: [2-oxo-2-(propylamino)ethyl] (2S)-2-(4-nitrophenyl)sulfonylpropanoate CAS Name: (2S)-2-(4-nitrophenyl)sulfonylpropanoic acid [2-oxo-2-(propylamino)ethyl] ester IUPAC Name: [2-oxo-2-(propylamino)ethyl] (2S)-2-(4-nitrophenyl)sulfonylpropanoate Traditional Name: (2S)-2-nosylpropionic acid [2-keto-2-(propylamino)ethyl] ester Formula: C14H18N2O7S MolecularWeight: 358.36692

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)COC(=O)C(C)S(=O)(=O)C1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CCCNC(=O)COC(=O)[C@H](C)S(=O)(=O)C1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C14H18N2O7S/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/h4-7,10H,3,8-9H2,1-2H3,(H,15,17)/t10-/m0/s1