2-(3-azanyl-2-ethyl-2H-1,4-benzodioxin-3-yl)propanoic acid

Systemtic Name: 2-(3-azanyl-2-ethyl-2H-1,4-benzodioxin-3-yl)propanoic acid Openeye Name: 2-(3-amino-2-ethyl-2H-1,4-benzodioxin-3-yl)propanoic acid CAS Name: 2-(3-amino-2-ethyl-2H-1,4-benzodioxin-3-yl)propanoic acid IUPAC Name: 2-(3-amino-2-ethyl-2H-1,4-benzodioxin-3-yl)propanoic acid Traditional Name: 2-(3-amino-2-ethyl-2H-1,4-benzodioxin-3-yl)propionic acid Formula: C13H17NO4 MolecularWeight: 251.27838

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(OC2=CC=CC=C2O1)(C(C)C(=O)O)N

Isomeric SMILES

CCC1C(OC2=CC=CC=C2O1)(C(C)C(=O)O)N

InChI

InChI=1S/C13H17NO4/c1-3-11-13(14,8(2)12(15)16)18-10-7-5-4-6-9(10)17-11/h4-8,11H,3,14H2,1-2H3,(H,15,16)