2-[3-(3-bromanyl-4-methoxy-phenyl)propanoylamino]-3-oxidanyl-propanoic acid

Systemtic Name: 2-[3-(3-bromanyl-4-methoxy-phenyl)propanoylamino]-3-oxidanyl-propanoic acid Openeye Name: 2-[3-(3-bromo-4-methoxy-phenyl)propanoylamino]-3-hydroxy-propanoic acid CAS Name: 2-[[3-(3-bromo-4-methoxyphenyl)-1-oxopropyl]amino]-3-hydroxypropanoic acid IUPAC Name: 2-[3-(3-bromo-4-methoxyphenyl)propanoylamino]-3-hydroxypropanoic acid Traditional Name: 2-[3-(3-bromo-4-methoxy-phenyl)propanoylamino]-3-hydroxy-propionic acid Formula: C13H16BrNO5 MolecularWeight: 346.17384

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCC(=O)NC(CO)C(=O)O)Br

Isomeric SMILES

COC1=C(C=C(C=C1)CCC(=O)NC(CO)C(=O)O)Br

InChI

InChI=1S/C13H16BrNO5/c1-20-11-4-2-8(6-9(11)14)3-5-12(17)15-10(7-16)13(18)19/h2,4,6,10,16H,3,5,7H2,1H3,(H,15,17)(H,18,19)