methyl 3-[(2-azanyl-5-iodanyl-phenyl)carbonylamino]butanoate

Systemtic Name: methyl 3-[(2-azanyl-5-iodanyl-phenyl)carbonylamino]butanoate Openeye Name: methyl 3-[(2-amino-5-iodo-benzoyl)amino]butanoate CAS Name: 3-[[(2-amino-5-iodophenyl)-oxomethyl]amino]butanoic acid methyl ester IUPAC Name: methyl 3-[(2-amino-5-iodobenzoyl)amino]butanoate Traditional Name: 3-[(2-amino-5-iodo-benzoyl)amino]butyric acid methyl ester Formula: C12H15IN2O3 MolecularWeight: 362.16357

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)OC)NC(=O)C1=C(C=CC(=C1)I)N

Isomeric SMILES

CC(CC(=O)OC)NC(=O)C1=C(C=CC(=C1)I)N

InChI

InChI=1S/C12H15IN2O3/c1-7(5-11(16)18-2)15-12(17)9-6-8(13)3-4-10(9)14/h3-4,6-7H,5,14H2,1-2H3,(H,15,17)