6-[(5-chloranyl-2,3-dihydro-1-benzofuran-2-yl)carbonylamino]hexanoic acid

Systemtic Name: 6-[(5-chloranyl-2,3-dihydro-1-benzofuran-2-yl)carbonylamino]hexanoic acid Openeye Name: 6-[(5-chloro-2,3-dihydrobenzofuran-2-carbonyl)amino]hexanoic acid CAS Name: 6-[[(5-chloro-2,3-dihydrobenzofuran-2-yl)-oxomethyl]amino]hexanoic acid IUPAC Name: 6-[(5-chloro-2,3-dihydro-1-benzofuran-2-carbonyl)amino]hexanoic acid Traditional Name: 6-[(5-chlorocoumaran-2-carbonyl)amino]hexanoic acid Formula: C15H18ClNO4 MolecularWeight: 311.76072

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H18ClNO4/c16-11-5-6-12-10(8-11)9-13(21-12)15(20)17-7-3-1-2-4-14(18)19/h5-6,8,13H,1-4,7,9H2,(H,17,20)(H,18,19)