[2-(cyclopropylcarbamoylamino)-2-oxidanylidene-ethyl] 4-bromanylbenzoate

Systemtic Name: [2-(cyclopropylcarbamoylamino)-2-oxidanylidene-ethyl] 4-bromanylbenzoate Openeye Name: [2-(cyclopropylcarbamoylamino)-2-oxo-ethyl] 4-bromobenzoate CAS Name: 4-bromobenzoic acid [2-[[(cyclopropylamino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(cyclopropylcarbamoylamino)-2-oxoethyl] 4-bromobenzoate Traditional Name: 4-bromobenzoic acid [2-(cyclopropylcarbamoylamino)-2-keto-ethyl] ester Formula: C13H13BrN2O4 MolecularWeight: 341.15732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)NC(=O)COC(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

C1CC1NC(=O)NC(=O)COC(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C13H13BrN2O4/c14-9-3-1-8(2-4-9)12(18)20-7-11(17)16-13(19)15-10-5-6-10/h1-4,10H,5-7H2,(H2,15,16,17,19)