[2-(furan-2-ylmethylcarbamoylamino)-2-oxidanylidene-ethyl] 2-[(3-bromophenyl)carbonylamino]ethanoate

Systemtic Name: [2-(furan-2-ylmethylcarbamoylamino)-2-oxidanylidene-ethyl] 2-[(3-bromophenyl)carbonylamino]ethanoate Openeye Name: [2-(2-furylmethylcarbamoylamino)-2-oxo-ethyl] 2-[(3-bromobenzoyl)amino]acetate CAS Name: 2-[[(3-bromophenyl)-oxomethyl]amino]acetic acid [2-[[(2-furanylmethylamino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(furan-2-ylmethylcarbamoylamino)-2-oxoethyl] 2-[(3-bromobenzoyl)amino]acetate Traditional Name: 2-[(3-bromobenzoyl)amino]acetic acid [2-(2-furfurylcarbamoylamino)-2-keto-ethyl] ester Formula: C17H16BrN3O6 MolecularWeight: 438.22944

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)C(=O)NCC(=O)OCC(=O)NC(=O)NCC2=CC=CO2

Isomeric SMILES

C1=CC(=CC(=C1)Br)C(=O)NCC(=O)OCC(=O)NC(=O)NCC2=CC=CO2

InChI

InChI=1S/C17H16BrN3O6/c18-12-4-1-3-11(7-12)16(24)19-9-15(23)27-10-14(22)21-17(25)20-8-13-5-2-6-26-13/h1-7H,8-10H2,(H,19,24)(H2,20,21,22,25)