6-fluoranyl-6-(phenylmethoxycarbonylamino)-2,3,4,5-tetrahydrochromene-4-carboxylic acid

Systemtic Name: 6-fluoranyl-6-(phenylmethoxycarbonylamino)-2,3,4,5-tetrahydrochromene-4-carboxylic acid Openeye Name: 6-(benzyloxycarbonylamino)-6-fluoro-2,3,4,5-tetrahydrochromene-4-carboxylic acid CAS Name: 6-fluoro-6-(phenylmethoxycarbonylamino)-2,3,4,5-tetrahydro-1-benzopyran-4-carboxylic acid IUPAC Name: 6-fluoro-6-(phenylmethoxycarbonylamino)-2,3,4,5-tetrahydrochromene-4-carboxylic acid Traditional Name: 6-(benzyloxycarbonylamino)-6-fluoro-2,3,4,5-tetrahydrochromene-4-carboxylic acid Formula: C18H18FNO5 MolecularWeight: 347.337623

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C1C(=O)O)CC(C=C2)(NC(=O)OCC3=CC=CC=C3)F

Isomeric SMILES

C1COC2=C(C1C(=O)O)CC(C=C2)(NC(=O)OCC3=CC=CC=C3)F

InChI

InChI=1S/C18H18FNO5/c19-18(20-17(23)25-11-12-4-2-1-3-5-12)8-6-15-14(10-18)13(16(21)22)7-9-24-15/h1-6,8,13H,7,9-11H2,(H,20,23)(H,21,22)