4-[4-[(3-bromanyl-1,2-oxazol-5-yl)carbonylamino]butanoylamino]butanoic acid

Systemtic Name: 4-[4-[(3-bromanyl-1,2-oxazol-5-yl)carbonylamino]butanoylamino]butanoic acid Openeye Name: 4-[4-[(3-bromoisoxazole-5-carbonyl)amino]butanoylamino]butanoic acid CAS Name: 4-[[4-[[(3-bromo-5-isoxazolyl)-oxomethyl]amino]-1-oxobutyl]amino]butanoic acid IUPAC Name: 4-[4-[(3-bromo-1,2-oxazole-5-carbonyl)amino]butanoylamino]butanoic acid Traditional Name: 4-[4-[(3-bromoisoxazole-5-carbonyl)amino]butanoylamino]butyric acid Formula: C12H16BrN3O5 MolecularWeight: 362.17654

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(ON=C1Br)C(=O)NCCCC(=O)NCCCC(=O)O

Isomeric SMILES

C1=C(ON=C1Br)C(=O)NCCCC(=O)NCCCC(=O)O

InChI

InChI=1S/C12H16BrN3O5/c13-9-7-8(21-16-9)12(20)15-6-1-3-10(17)14-5-2-4-11(18)19/h7H,1-6H2,(H,14,17)(H,15,20)(H,18,19)