2-chloranylprop-2-enyl 2-[(2-chloranyl-4-nitro-phenyl)carbonylamino]-4-methylsulfanyl-butanoate

Systemtic Name: 2-chloranylprop-2-enyl 2-[(2-chloranyl-4-nitro-phenyl)carbonylamino]-4-methylsulfanyl-butanoate Openeye Name: 2-chloroallyl 2-[(2-chloro-4-nitro-benzoyl)amino]-4-methylsulfanyl-butanoate CAS Name: 2-[[(2-chloro-4-nitrophenyl)-oxomethyl]amino]-4-(methylthio)butanoic acid 2-chloroprop-2-enyl ester IUPAC Name: 2-chloroprop-2-enyl 2-[(2-chloro-4-nitrobenzoyl)amino]-4-methylsulfanylbutanoate Traditional Name: 2-[(2-chloro-4-nitro-benzoyl)amino]-4-(methylthio)butyric acid 2-chloroallyl ester Formula: C15H16Cl2N2O5S MolecularWeight: 407.26894

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)OCC(=C)Cl)NC(=O)C1=C(C=C(C=C1)[N+](=O)[O-])Cl

Isomeric SMILES

CSCCC(C(=O)OCC(=C)Cl)NC(=O)C1=C(C=C(C=C1)[N+](=O)[O-])Cl

InChI

InChI=1S/C15H16Cl2N2O5S/c1-9(16)8-24-15(21)13(5-6-25-2)18-14(20)11-4-3-10(19(22)23)7-12(11)17/h3-4,7,13H,1,5-6,8H2,2H3,(H,18,20)