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

Systemtic Name: 4-[(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)carbonyl-methyl-amino]butanoic acid Openeye Name: 4-[(5-chloro-2,3-dihydro-1,4-benzodioxine-7-carbonyl)-methyl-amino]butanoic acid CAS Name: 4-[[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-oxomethyl]-methylamino]butanoic acid IUPAC Name: 4-[(5-chloro-2,3-dihydro-1,4-benzodioxine-7-carbonyl)-methylamino]butanoic acid Traditional Name: 4-[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-carbonyl)-methyl-amino]butyric acid Formula: C14H16ClNO5 MolecularWeight: 313.73354

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC(=O)O)C(=O)C1=CC2=C(C(=C1)Cl)OCCO2

Isomeric SMILES

CN(CCCC(=O)O)C(=O)C1=CC2=C(C(=C1)Cl)OCCO2

InChI

InChI=1S/C14H16ClNO5/c1-16(4-2-3-12(17)18)14(19)9-7-10(15)13-11(8-9)20-5-6-21-13/h7-8H,2-6H2,1H3,(H,17,18)