4-[(5-chloranyl-2,3-dihydro-1-benzofuran-2-yl)carbonylamino]butanoic acid

Systemtic Name: 4-[(5-chloranyl-2,3-dihydro-1-benzofuran-2-yl)carbonylamino]butanoic acid Openeye Name: 4-[(5-chloro-2,3-dihydrobenzofuran-2-carbonyl)amino]butanoic acid CAS Name: 4-[[(5-chloro-2,3-dihydrobenzofuran-2-yl)-oxomethyl]amino]butanoic acid IUPAC Name: 4-[(5-chloro-2,3-dihydro-1-benzofuran-2-carbonyl)amino]butanoic acid Traditional Name: 4-[(5-chlorocoumaran-2-carbonyl)amino]butyric acid Formula: C13H14ClNO4 MolecularWeight: 283.70756

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=C1C=C(C=C2)Cl)C(=O)NCCCC(=O)O

Isomeric SMILES

C1C(OC2=C1C=C(C=C2)Cl)C(=O)NCCCC(=O)O

InChI

InChI=1S/C13H14ClNO4/c14-9-3-4-10-8(6-9)7-11(19-10)13(18)15-5-1-2-12(16)17/h3-4,6,11H,1-2,5,7H2,(H,15,18)(H,16,17)