[1-(aminocarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] 3-bromanylbenzoate

Systemtic Name: [1-(aminocarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] 3-bromanylbenzoate Openeye Name: (1-allophanoyl-2-methyl-propyl) 3-bromobenzoate CAS Name: 3-bromobenzoic acid [1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] ester IUPAC Name: [1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] 3-bromobenzoate Traditional Name: 3-bromobenzoic acid (1-allophanoyl-2-methyl-propyl) ester Formula: C13H15BrN2O4 MolecularWeight: 343.1732

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC(=O)N)OC(=O)C1=CC(=CC=C1)Br

Isomeric SMILES

CC(C)C(C(=O)NC(=O)N)OC(=O)C1=CC(=CC=C1)Br

InChI

InChI=1S/C13H15BrN2O4/c1-7(2)10(11(17)16-13(15)19)20-12(18)8-4-3-5-9(14)6-8/h3-7,10H,1-2H3,(H3,15,16,17,19)