methyl 3-[(1-methylsulfanyl-2-nitro-ethenyl)amino]propanoate

Systemtic Name: methyl 3-[(1-methylsulfanyl-2-nitro-ethenyl)amino]propanoate Openeye Name: methyl 3-[(1-methylsulfanyl-2-nitro-vinyl)amino]propanoate CAS Name: 3-[[1-(methylthio)-2-nitroethenyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-[(1-methylsulfanyl-2-nitroethenyl)amino]propanoate Traditional Name: 3-[[1-(methylthio)-2-nitro-vinyl]amino]propionic acid methyl ester Formula: C7H12N2O4S MolecularWeight: 220.24618

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCNC(=C[N+](=O)[O-])SC

Isomeric SMILES

COC(=O)CCNC(=C[N+](=O)[O-])SC

InChI

InChI=1S/C7H12N2O4S/c1-13-7(10)3-4-8-6(14-2)5-9(11)12/h5,8H,3-4H2,1-2H3