2-[4-(4-bromanylphenoxy)butanoylamino]-3-oxidanyl-propanoic acid

Systemtic Name: 2-[4-(4-bromanylphenoxy)butanoylamino]-3-oxidanyl-propanoic acid Openeye Name: 2-[4-(4-bromophenoxy)butanoylamino]-3-hydroxy-propanoic acid CAS Name: 2-[[4-(4-bromophenoxy)-1-oxobutyl]amino]-3-hydroxypropanoic acid IUPAC Name: 2-[4-(4-bromophenoxy)butanoylamino]-3-hydroxypropanoic acid Traditional Name: 2-[4-(4-bromophenoxy)butanoylamino]-3-hydroxy-propionic acid Formula: C13H16BrNO5 MolecularWeight: 346.17384

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1OCCCC(=O)NC(CO)C(=O)O)Br

Isomeric SMILES

C1=CC(=CC=C1OCCCC(=O)NC(CO)C(=O)O)Br

InChI

InChI=1S/C13H16BrNO5/c14-9-3-5-10(6-4-9)20-7-1-2-12(17)15-11(8-16)13(18)19/h3-6,11,16H,1-2,7-8H2,(H,15,17)(H,18,19)