[2-oxidanylidene-2-(propylcarbamoylamino)ethyl] 2-(2-bromanyl-4,5-dimethoxy-phenyl)ethanoate

Systemtic Name: [2-oxidanylidene-2-(propylcarbamoylamino)ethyl] 2-(2-bromanyl-4,5-dimethoxy-phenyl)ethanoate Openeye Name: [2-oxo-2-(propylcarbamoylamino)ethyl] 2-(2-bromo-4,5-dimethoxy-phenyl)acetate CAS Name: 2-(2-bromo-4,5-dimethoxyphenyl)acetic acid [2-oxo-2-[[oxo(propylamino)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(propylcarbamoylamino)ethyl] 2-(2-bromo-4,5-dimethoxyphenyl)acetate Traditional Name: 2-(2-bromo-4,5-dimethoxy-phenyl)acetic acid [2-keto-2-(propylcarbamoylamino)ethyl] ester Formula: C16H21BrN2O6 MolecularWeight: 417.25174

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)NC(=O)COC(=O)CC1=CC(=C(C=C1Br)OC)OC

Isomeric SMILES

CCCNC(=O)NC(=O)COC(=O)CC1=CC(=C(C=C1Br)OC)OC

InChI

InChI=1S/C16H21BrN2O6/c1-4-5-18-16(22)19-14(20)9-25-15(21)7-10-6-12(23-2)13(24-3)8-11(10)17/h6,8H,4-5,7,9H2,1-3H3,(H2,18,19,20,22)