ethyl 4-methylsulfanyl-2-[2-(3-nitrophenyl)ethanoylamino]butanoate

Systemtic Name: ethyl 4-methylsulfanyl-2-[2-(3-nitrophenyl)ethanoylamino]butanoate Openeye Name: ethyl 4-methylsulfanyl-2-[[2-(3-nitrophenyl)acetyl]amino]butanoate CAS Name: 4-(methylthio)-2-[[2-(3-nitrophenyl)-1-oxoethyl]amino]butanoic acid ethyl ester IUPAC Name: ethyl 4-methylsulfanyl-2-[[2-(3-nitrophenyl)acetyl]amino]butanoate Traditional Name: 4-(methylthio)-2-[[2-(3-nitrophenyl)acetyl]amino]butyric acid ethyl ester Formula: C15H20N2O5S MolecularWeight: 340.3947

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCSC)NC(=O)CC1=CC(=CC=C1)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C(CCSC)NC(=O)CC1=CC(=CC=C1)[N+](=O)[O-]

InChI

InChI=1S/C15H20N2O5S/c1-3-22-15(19)13(7-8-23-2)16-14(18)10-11-5-4-6-12(9-11)17(20)21/h4-6,9,13H,3,7-8,10H2,1-2H3,(H,16,18)