[2-(3-methylbutylcarbamoylamino)-2-oxidanylidene-ethyl] 3-iodanylbenzoate

Systemtic Name: [2-(3-methylbutylcarbamoylamino)-2-oxidanylidene-ethyl] 3-iodanylbenzoate Openeye Name: [2-(isopentylcarbamoylamino)-2-oxo-ethyl] 3-iodobenzoate CAS Name: 3-iodobenzoic acid [2-[[(3-methylbutylamino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(3-methylbutylcarbamoylamino)-2-oxoethyl] 3-iodobenzoate Traditional Name: 3-iodobenzoic acid [2-(isoamylcarbamoylamino)-2-keto-ethyl] ester Formula: C15H19IN2O4 MolecularWeight: 418.22683

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19IN2O4/c1-10(2)6-7-17-15(21)18-13(19)9-22-14(20)11-4-3-5-12(16)8-11/h3-5,8,10H,6-7,9H2,1-2H3,(H2,17,18,19,21)