[1-(ethylcarbamoylamino)-1-oxidanylidene-propan-2-yl] 4-(3-bromanylphenoxy)butanoate

Systemtic Name: [1-(ethylcarbamoylamino)-1-oxidanylidene-propan-2-yl] 4-(3-bromanylphenoxy)butanoate Openeye Name: [2-(ethylcarbamoylamino)-1-methyl-2-oxo-ethyl] 4-(3-bromophenoxy)butanoate CAS Name: 4-(3-bromophenoxy)butanoic acid [1-(ethylcarbamoylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(ethylcarbamoylamino)-1-oxopropan-2-yl] 4-(3-bromophenoxy)butanoate Traditional Name: 4-(3-bromophenoxy)butyric acid [2-(ethylcarbamoylamino)-2-keto-1-methyl-ethyl] ester Formula: C16H21BrN2O5 MolecularWeight: 401.25234

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC(=O)C(C)OC(=O)CCCOC1=CC(=CC=C1)Br

Isomeric SMILES

CCNC(=O)NC(=O)C(C)OC(=O)CCCOC1=CC(=CC=C1)Br

InChI

InChI=1S/C16H21BrN2O5/c1-3-18-16(22)19-15(21)11(2)24-14(20)8-5-9-23-13-7-4-6-12(17)10-13/h4,6-7,10-11H,3,5,8-9H2,1-2H3,(H2,18,19,21,22)