3,6,6-trimethyl-4-oxidanylidene-N-(pyridin-2-ylmethyl)-5,7-dihydro-1-benzofuran-2-carboxamide

Systemtic Name: 3,6,6-trimethyl-4-oxidanylidene-N-(pyridin-2-ylmethyl)-5,7-dihydro-1-benzofuran-2-carboxamide Openeye Name: 3,6,6-trimethyl-4-oxo-N-(2-pyridylmethyl)-5,7-dihydrobenzofuran-2-carboxamide CAS Name: 3,6,6-trimethyl-4-oxo-N-(2-pyridinylmethyl)-5,7-dihydrobenzofuran-2-carboxamide IUPAC Name: 3,6,6-trimethyl-4-oxo-N-(pyridin-2-ylmethyl)-5,7-dihydro-1-benzofuran-2-carboxamide Traditional Name: 4-keto-3,6,6-trimethyl-N-(2-pyridylmethyl)-5,7-dihydrobenzofuran-2-carboxamide Formula: C18H20N2O3 MolecularWeight: 312.363

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(=O)CC(C2)(C)C)C(=O)NCC3=CC=CC=N3

Isomeric SMILES

CC1=C(OC2=C1C(=O)CC(C2)(C)C)C(=O)NCC3=CC=CC=N3

InChI

InChI=1S/C18H20N2O3/c1-11-15-13(21)8-18(2,3)9-14(15)23-16(11)17(22)20-10-12-6-4-5-7-19-12/h4-7H,8-10H2,1-3H3,(H,20,22)