4-azanyl-2-[2-[(5-bromanylfuran-2-yl)carbonylamino]ethanoylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-azanyl-2-[2-[(5-bromanylfuran-2-yl)carbonylamino]ethanoylamino]-4-oxidanylidene-butanoic acid Openeye Name: 4-amino-2-[[2-[(5-bromofuran-2-carbonyl)amino]acetyl]amino]-4-oxo-butanoic acid CAS Name: 4-amino-2-[[2-[[(5-bromo-2-furanyl)-oxomethyl]amino]-1-oxoethyl]amino]-4-oxobutanoic acid IUPAC Name: 4-amino-2-[[2-[(5-bromofuran-2-carbonyl)amino]acetyl]amino]-4-oxobutanoic acid Traditional Name: 4-amino-2-[[2-[(5-bromo-2-furoyl)amino]acetyl]amino]-4-keto-butyric acid Formula: C11H12BrN3O6 MolecularWeight: 362.13348

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H12BrN3O6/c12-7-2-1-6(21-7)10(18)14-4-9(17)15-5(11(19)20)3-8(13)16/h1-2,5H,3-4H2,(H2,13,16)(H,14,18)(H,15,17)(H,19,20)