methyl 5-[(4-iodophenyl)amino]-5-oxidanylidene-pentanoate

Systemtic Name: methyl 5-[(4-iodophenyl)amino]-5-oxidanylidene-pentanoate Openeye Name: methyl 5-(4-iodoanilino)-5-oxo-pentanoate CAS Name: 5-(4-iodoanilino)-5-oxopentanoic acid methyl ester IUPAC Name: methyl 5-(4-iodoanilino)-5-oxopentanoate Traditional Name: 5-(4-iodoanilino)-5-keto-valeric acid methyl ester Formula: C12H14INO3 MolecularWeight: 347.14893

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCC(=O)NC1=CC=C(C=C1)I

Isomeric SMILES

COC(=O)CCCC(=O)NC1=CC=C(C=C1)I

InChI

InChI=1S/C12H14INO3/c1-17-12(16)4-2-3-11(15)14-10-7-5-9(13)6-8-10/h5-8H,2-4H2,1H3,(H,14,15)