[2-oxidanylidene-2-(prop-2-ynylamino)ethyl] 4-iodanylbenzoate

Systemtic Name: [2-oxidanylidene-2-(prop-2-ynylamino)ethyl] 4-iodanylbenzoate Openeye Name: [2-oxo-2-(prop-2-ynylamino)ethyl] 4-iodobenzoate CAS Name: 4-iodobenzoic acid [2-oxo-2-(prop-2-ynylamino)ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-ynylamino)ethyl] 4-iodobenzoate Traditional Name: 4-iodobenzoic acid [2-keto-2-(propargylamino)ethyl] ester Formula: C12H10INO3 MolecularWeight: 343.11717

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C#CCNC(=O)COC(=O)C1=CC=C(C=C1)I

Isomeric SMILES

C#CCNC(=O)COC(=O)C1=CC=C(C=C1)I

InChI

InChI=1S/C12H10INO3/c1-2-7-14-11(15)8-17-12(16)9-3-5-10(13)6-4-9/h1,3-6H,7-8H2,(H,14,15)