(4-acetamidophenyl) 1,7,7-trimethyl-2-oxidanylidene-3-oxabicyclo[2.2.1]heptane-4-carboxylate

Systemtic Name: (4-acetamidophenyl) 1,7,7-trimethyl-2-oxidanylidene-3-oxabicyclo[2.2.1]heptane-4-carboxylate Openeye Name: (4-acetamidophenyl) 1,7,7-trimethyl-2-oxo-3-oxabicyclo[2.2.1]heptane-4-carboxylate CAS Name: 1,7,7-trimethyl-2-oxo-3-oxabicyclo[2.2.1]heptane-4-carboxylic acid (4-acetamidophenyl) ester IUPAC Name: (4-acetamidophenyl) 1,7,7-trimethyl-2-oxo-3-oxabicyclo[2.2.1]heptane-4-carboxylate Traditional Name: 2-keto-1,7,7-trimethyl-3-oxabicyclo[2.2.1]heptane-4-carboxylic acid (4-acetamidophenyl) ester Formula: C18H21NO5 MolecularWeight: 331.36304

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)OC(=O)C23CCC(C2(C)C)(C(=O)O3)C

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)OC(=O)C23CCC(C2(C)C)(C(=O)O3)C

InChI

InChI=1S/C18H21NO5/c1-11(20)19-12-5-7-13(8-6-12)23-15(22)18-10-9-17(4,14(21)24-18)16(18,2)3/h5-8H,9-10H2,1-4H3,(H,19,20)