4-(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)butanoic acid

Systemtic Name: 4-(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)butanoic acid Openeye Name: 4-(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)butanoic acid CAS Name: 4-(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)butanoic acid IUPAC Name: 4-(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)butanoic acid Traditional Name: 4-(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)butyric acid Formula: C13H17NO4 MolecularWeight: 251.27838

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C2O1)CNCCCC(=O)O

Isomeric SMILES

C1C(OC2=CC=CC=C2O1)CNCCCC(=O)O

InChI

InChI=1S/C13H17NO4/c15-13(16)6-3-7-14-8-10-9-17-11-4-1-2-5-12(11)18-10/h1-2,4-5,10,14H,3,6-9H2,(H,15,16)