methyl 3-[1-[(3-aminophenyl)amino]-1-oxidanylidene-propan-2-yl]sulfonylpropanoate

Systemtic Name: methyl 3-[1-[(3-aminophenyl)amino]-1-oxidanylidene-propan-2-yl]sulfonylpropanoate Openeye Name: methyl 3-[2-(3-aminoanilino)-1-methyl-2-oxo-ethyl]sulfonylpropanoate CAS Name: 3-[1-(3-aminoanilino)-1-oxopropan-2-yl]sulfonylpropanoic acid methyl ester IUPAC Name: methyl 3-[1-(3-aminoanilino)-1-oxopropan-2-yl]sulfonylpropanoate Traditional Name: 3-[2-(3-aminoanilino)-2-keto-1-methyl-ethyl]sulfonylpropionic acid methyl ester Formula: C13H18N2O5S MolecularWeight: 314.35742

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18N2O5S/c1-9(21(18,19)7-6-12(16)20-2)13(17)15-11-5-3-4-10(14)8-11/h3-5,8-9H,6-7,14H2,1-2H3,(H,15,17)