methyl 4-[(3-iodanyl-4-methyl-phenyl)amino]-4-oxidanylidene-butanoate

Systemtic Name: methyl 4-[(3-iodanyl-4-methyl-phenyl)amino]-4-oxidanylidene-butanoate Openeye Name: methyl 4-(3-iodo-4-methyl-anilino)-4-oxo-butanoate CAS Name: 4-(3-iodo-4-methylanilino)-4-oxobutanoic acid methyl ester IUPAC Name: methyl 4-(3-iodo-4-methylanilino)-4-oxobutanoate Traditional Name: 4-(3-iodo-4-methyl-anilino)-4-keto-butyric acid methyl ester Formula: C12H14INO3 MolecularWeight: 347.14893

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CCC(=O)OC)I

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CCC(=O)OC)I

InChI

InChI=1S/C12H14INO3/c1-8-3-4-9(7-10(8)13)14-11(15)5-6-12(16)17-2/h3-4,7H,5-6H2,1-2H3,(H,14,15)