methyl (2R)-2-[(4-ethoxy-3-nitro-phenyl)carbonylamino]-4-methylsulfanyl-butanoate

Systemtic Name: methyl (2R)-2-[(4-ethoxy-3-nitro-phenyl)carbonylamino]-4-methylsulfanyl-butanoate Openeye Name: methyl (2R)-2-[(4-ethoxy-3-nitro-benzoyl)amino]-4-methylsulfanyl-butanoate CAS Name: (2R)-2-[[(4-ethoxy-3-nitrophenyl)-oxomethyl]amino]-4-(methylthio)butanoic acid methyl ester IUPAC Name: methyl (2R)-2-[(4-ethoxy-3-nitrobenzoyl)amino]-4-methylsulfanylbutanoate Traditional Name: (2R)-2-[(4-ethoxy-3-nitro-benzoyl)amino]-4-(methylthio)butyric acid methyl ester Formula: C15H20N2O6S MolecularWeight: 356.3941

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NC(CCSC)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)N[C@H](CCSC)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C15H20N2O6S/c1-4-23-13-6-5-10(9-12(13)17(20)21)14(18)16-11(7-8-24-3)15(19)22-2/h5-6,9,11H,4,7-8H2,1-3H3,(H,16,18)/t11-/m1/s1