[2-oxidanylidene-2-(pentan-3-ylamino)ethyl] 3-iodanylbenzoate

Systemtic Name: [2-oxidanylidene-2-(pentan-3-ylamino)ethyl] 3-iodanylbenzoate Openeye Name: [2-(1-ethylpropylamino)-2-oxo-ethyl] 3-iodobenzoate CAS Name: 3-iodobenzoic acid [2-oxo-2-(pentan-3-ylamino)ethyl] ester IUPAC Name: [2-oxo-2-(pentan-3-ylamino)ethyl] 3-iodobenzoate Traditional Name: 3-iodobenzoic acid [2-(1-ethylpropylamino)-2-keto-ethyl] ester Formula: C14H18INO3 MolecularWeight: 375.20209

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC(=O)COC(=O)C1=CC(=CC=C1)I

Isomeric SMILES

CCC(CC)NC(=O)COC(=O)C1=CC(=CC=C1)I

InChI

InChI=1S/C14H18INO3/c1-3-12(4-2)16-13(17)9-19-14(18)10-6-5-7-11(15)8-10/h5-8,12H,3-4,9H2,1-2H3,(H,16,17)