4-[[3-(2-methylphenoxy)-2-oxidanyl-propyl]amino]butanoic acid

Systemtic Name: 4-[[3-(2-methylphenoxy)-2-oxidanyl-propyl]amino]butanoic acid Openeye Name: 4-[[2-hydroxy-3-(2-methylphenoxy)propyl]amino]butanoic acid CAS Name: 4-[[2-hydroxy-3-(2-methylphenoxy)propyl]amino]butanoic acid IUPAC Name: 4-[[2-hydroxy-3-(2-methylphenoxy)propyl]amino]butanoic acid Traditional Name: 4-[[2-hydroxy-3-(2-methylphenoxy)propyl]amino]butyric acid Formula: C14H21NO4 MolecularWeight: 267.32084

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCC(CNCCCC(=O)O)O

Isomeric SMILES

CC1=CC=CC=C1OCC(CNCCCC(=O)O)O

InChI

InChI=1S/C14H21NO4/c1-11-5-2-3-6-13(11)19-10-12(16)9-15-8-4-7-14(17)18/h2-3,5-6,12,15-16H,4,7-10H2,1H3,(H,17,18)