phenyl (2R)-4-methylsulfanyl-2-[(3-nitrophenyl)carbonylamino]butanoate

Systemtic Name: phenyl (2R)-4-methylsulfanyl-2-[(3-nitrophenyl)carbonylamino]butanoate Openeye Name: phenyl (2R)-4-methylsulfanyl-2-[(3-nitrobenzoyl)amino]butanoate CAS Name: (2R)-4-(methylthio)-2-[[(3-nitrophenyl)-oxomethyl]amino]butanoic acid phenyl ester IUPAC Name: phenyl (2R)-4-methylsulfanyl-2-[(3-nitrobenzoyl)amino]butanoate Traditional Name: (2R)-4-(methylthio)-2-[(3-nitrobenzoyl)amino]butyric acid phenyl ester Formula: C18H18N2O5S MolecularWeight: 374.41092

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)OC1=CC=CC=C1)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CSCC[C@H](C(=O)OC1=CC=CC=C1)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H18N2O5S/c1-26-11-10-16(18(22)25-15-8-3-2-4-9-15)19-17(21)13-6-5-7-14(12-13)20(23)24/h2-9,12,16H,10-11H2,1H3,(H,19,21)/t16-/m1/s1