[2-(tert-butylamino)-2-oxidanylidene-ethyl] 3-iodanylbenzoate

Systemtic Name: [2-(tert-butylamino)-2-oxidanylidene-ethyl] 3-iodanylbenzoate Openeye Name: [2-(tert-butylamino)-2-oxo-ethyl] 3-iodobenzoate CAS Name: 3-iodobenzoic acid [2-(tert-butylamino)-2-oxoethyl] ester IUPAC Name: [2-(tert-butylamino)-2-oxoethyl] 3-iodobenzoate Traditional Name: 3-iodobenzoic acid [2-(tert-butylamino)-2-keto-ethyl] ester Formula: C13H16INO3 MolecularWeight: 361.17551

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16INO3/c1-13(2,3)15-11(16)8-18-12(17)9-5-4-6-10(14)7-9/h4-7H,8H2,1-3H3,(H,15,16)