2-[1-[[(3-oxidanylidene-1H-2-benzofuran-1-yl)oxycarbonylamino]methyl]cyclohexyl]ethanoic acid

Systemtic Name: 2-[1-[[(3-oxidanylidene-1H-2-benzofuran-1-yl)oxycarbonylamino]methyl]cyclohexyl]ethanoic acid Openeye Name: 2-[1-[[(3-oxo-1H-isobenzofuran-1-yl)oxycarbonylamino]methyl]cyclohexyl]acetic acid CAS Name: 2-[1-[[[oxo-[(3-oxo-1H-isobenzofuran-1-yl)oxy]methyl]amino]methyl]cyclohexyl]acetic acid IUPAC Name: 2-[1-[[(3-oxo-1H-2-benzofuran-1-yl)oxycarbonylamino]methyl]cyclohexyl]acetic acid Traditional Name: 2-[1-[(phthalidyloxycarbonylamino)methyl]cyclohexyl]acetic acid Formula: C18H21NO6 MolecularWeight: 347.36244

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(CC(=O)O)CNC(=O)OC2C3=CC=CC=C3C(=O)O2

Isomeric SMILES

C1CCC(CC1)(CC(=O)O)CNC(=O)OC2C3=CC=CC=C3C(=O)O2

InChI

InChI=1S/C18H21NO6/c20-14(21)10-18(8-4-1-5-9-18)11-19-17(23)25-16-13-7-3-2-6-12(13)15(22)24-16/h2-3,6-7,16H,1,4-5,8-11H2,(H,19,23)(H,20,21)