3-oxidanylidene-2-[(5-phenyl-1,2-oxazol-3-yl)methyl]-4,5,6,7-tetrahydro-1-benzofuran-6-carboxylic acid

Systemtic Name: 3-oxidanylidene-2-[(5-phenyl-1,2-oxazol-3-yl)methyl]-4,5,6,7-tetrahydro-1-benzofuran-6-carboxylic acid Openeye Name: 3-oxo-2-[(5-phenylisoxazol-3-yl)methyl]-4,5,6,7-tetrahydrobenzofuran-6-carboxylic acid CAS Name: 3-oxo-2-[(5-phenyl-3-isoxazolyl)methyl]-4,5,6,7-tetrahydrobenzofuran-6-carboxylic acid IUPAC Name: 3-oxo-2-[(5-phenyl-1,2-oxazol-3-yl)methyl]-4,5,6,7-tetrahydro-1-benzofuran-6-carboxylic acid Traditional Name: 3-keto-2-[(5-phenylisoxazol-3-yl)methyl]-4,5,6,7-tetrahydrobenzofuran-6-carboxylic acid Formula: C19H17NO5 MolecularWeight: 339.34198

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(CC1C(=O)O)OC(C2=O)CC3=NOC(=C3)C4=CC=CC=C4

Isomeric SMILES

C1CC2=C(CC1C(=O)O)OC(C2=O)CC3=NOC(=C3)C4=CC=CC=C4

InChI

InChI=1S/C19H17NO5/c21-18-14-7-6-12(19(22)23)8-16(14)24-17(18)10-13-9-15(25-20-13)11-4-2-1-3-5-11/h1-5,9,12,17H,6-8,10H2,(H,22,23)