ethyl 2-[2-[(5-chloranyl-2-nitro-phenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoate

Systemtic Name: ethyl 2-[2-[(5-chloranyl-2-nitro-phenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoate Openeye Name: ethyl 2-[2-(5-chloro-2-nitro-anilino)-2-oxo-ethyl]sulfanylacetate CAS Name: 2-[[2-(5-chloro-2-nitroanilino)-2-oxoethyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-(5-chloro-2-nitroanilino)-2-oxoethyl]sulfanylacetate Traditional Name: 2-[[2-(5-chloro-2-nitro-anilino)-2-keto-ethyl]thio]acetic acid ethyl ester Formula: C12H13ClN2O5S MolecularWeight: 332.76002

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSCC(=O)NC1=C(C=CC(=C1)Cl)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)CSCC(=O)NC1=C(C=CC(=C1)Cl)[N+](=O)[O-]

InChI

InChI=1S/C12H13ClN2O5S/c1-2-20-12(17)7-21-6-11(16)14-9-5-8(13)3-4-10(9)15(18)19/h3-5H,2,6-7H2,1H3,(H,14,16)