[2-oxidanylidene-2-(propylamino)ethyl] 2-azanyl-5-iodanyl-benzoate

Systemtic Name: [2-oxidanylidene-2-(propylamino)ethyl] 2-azanyl-5-iodanyl-benzoate Openeye Name: [2-oxo-2-(propylamino)ethyl] 2-amino-5-iodo-benzoate CAS Name: 2-amino-5-iodobenzoic acid [2-oxo-2-(propylamino)ethyl] ester IUPAC Name: [2-oxo-2-(propylamino)ethyl] 2-amino-5-iodobenzoate Traditional Name: 2-amino-5-iodo-benzoic acid [2-keto-2-(propylamino)ethyl] ester Formula: C12H15IN2O3 MolecularWeight: 362.16357

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)COC(=O)C1=C(C=CC(=C1)I)N

Isomeric SMILES

CCCNC(=O)COC(=O)C1=C(C=CC(=C1)I)N

InChI

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