ethyl 2-[2-[(4-methyl-2-nitro-phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]sulfanylethanoate

Systemtic Name: ethyl 2-[2-[(4-methyl-2-nitro-phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]sulfanylethanoate Openeye Name: ethyl 2-[2-(4-methyl-2-nitro-anilino)-2-oxo-1-phenyl-ethyl]sulfanylacetate CAS Name: 2-[[2-(4-methyl-2-nitroanilino)-2-oxo-1-phenylethyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-(4-methyl-2-nitroanilino)-2-oxo-1-phenylethyl]sulfanylacetate Traditional Name: 2-[[2-keto-2-(4-methyl-2-nitro-anilino)-1-phenyl-ethyl]thio]acetic acid ethyl ester Formula: C19H20N2O5S MolecularWeight: 388.4375

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC(C1=CC=CC=C1)C(=O)NC2=C(C=C(C=C2)C)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)CSC(C1=CC=CC=C1)C(=O)NC2=C(C=C(C=C2)C)[N+](=O)[O-]

InChI

InChI=1S/C19H20N2O5S/c1-3-26-17(22)12-27-18(14-7-5-4-6-8-14)19(23)20-15-10-9-13(2)11-16(15)21(24)25/h4-11,18H,3,12H2,1-2H3,(H,20,23)