methyl 2-[1-[(4-aminophenyl)amino]-1-oxidanylidene-propan-2-yl]sulfonylethanoate

Systemtic Name: methyl 2-[1-[(4-aminophenyl)amino]-1-oxidanylidene-propan-2-yl]sulfonylethanoate Openeye Name: methyl 2-[2-(4-aminoanilino)-1-methyl-2-oxo-ethyl]sulfonylacetate CAS Name: 2-[1-(4-aminoanilino)-1-oxopropan-2-yl]sulfonylacetic acid methyl ester IUPAC Name: methyl 2-[1-(4-aminoanilino)-1-oxopropan-2-yl]sulfonylacetate Traditional Name: 2-[2-(4-aminoanilino)-2-keto-1-methyl-ethyl]sulfonylacetic acid methyl ester Formula: C12H16N2O5S MolecularWeight: 300.33084

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)N)S(=O)(=O)CC(=O)OC

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)N)S(=O)(=O)CC(=O)OC

InChI

InChI=1S/C12H16N2O5S/c1-8(20(17,18)7-11(15)19-2)12(16)14-10-5-3-9(13)4-6-10/h3-6,8H,7,13H2,1-2H3,(H,14,16)