4-[(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)methylamino]butanoic acid

Systemtic Name: 4-[(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)methylamino]butanoic acid Openeye Name: 4-[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methylamino]butanoic acid CAS Name: 4-[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methylamino]butanoic acid IUPAC Name: 4-[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methylamino]butanoic acid Traditional Name: 4-[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methylamino]butyric acid Formula: C13H16ClNO4 MolecularWeight: 285.72344

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=C(C=C2Cl)CNCCCC(=O)O

Isomeric SMILES

C1COC2=C(O1)C=C(C=C2Cl)CNCCCC(=O)O

InChI

InChI=1S/C13H16ClNO4/c14-10-6-9(8-15-3-1-2-12(16)17)7-11-13(10)19-5-4-18-11/h6-7,15H,1-5,8H2,(H,16,17)