2-[3-(3-methylphenoxy)propanoylamino]-3-oxidanyl-butanoic acid

Systemtic Name: 2-[3-(3-methylphenoxy)propanoylamino]-3-oxidanyl-butanoic acid Openeye Name: 3-hydroxy-2-[3-(3-methylphenoxy)propanoylamino]butanoic acid CAS Name: 3-hydroxy-2-[[3-(3-methylphenoxy)-1-oxopropyl]amino]butanoic acid IUPAC Name: 3-hydroxy-2-[3-(3-methylphenoxy)propanoylamino]butanoic acid Traditional Name: 3-hydroxy-2-[3-(3-methylphenoxy)propanoylamino]butyric acid Formula: C14H19NO5 MolecularWeight: 281.30436

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCC(=O)NC(C(C)O)C(=O)O

Isomeric SMILES

CC1=CC(=CC=C1)OCCC(=O)NC(C(C)O)C(=O)O

InChI

InChI=1S/C14H19NO5/c1-9-4-3-5-11(8-9)20-7-6-12(17)15-13(10(2)16)14(18)19/h3-5,8,10,13,16H,6-7H2,1-2H3,(H,15,17)(H,18,19)