ethyl 2-[2-[(3-azanyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfonylethanoate

Systemtic Name: ethyl 2-[2-[(3-azanyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfonylethanoate Openeye Name: ethyl 2-[2-(3-amino-4-methyl-anilino)-2-oxo-ethyl]sulfonylacetate CAS Name: 2-[2-(3-amino-4-methylanilino)-2-oxoethyl]sulfonylacetic acid ethyl ester IUPAC Name: ethyl 2-[2-(3-amino-4-methylanilino)-2-oxoethyl]sulfonylacetate Traditional Name: 2-[2-(3-amino-4-methyl-anilino)-2-keto-ethyl]sulfonylacetic acid ethyl ester Formula: C13H18N2O5S MolecularWeight: 314.35742

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CS(=O)(=O)CC(=O)NC1=CC(=C(C=C1)C)N

Isomeric SMILES

CCOC(=O)CS(=O)(=O)CC(=O)NC1=CC(=C(C=C1)C)N

InChI

InChI=1S/C13H18N2O5S/c1-3-20-13(17)8-21(18,19)7-12(16)15-10-5-4-9(2)11(14)6-10/h4-6H,3,7-8,14H2,1-2H3,(H,15,16)