7,7-dimethyl-3-phenyl-5,6-dihydro-1-benzofuran-4-one; 7,7-dimethyl-3-phenyl-2-pyridin-4-yl-5,6-dihydro-1-benzofuran-4-one

Systemtic Name: 7,7-dimethyl-3-phenyl-5,6-dihydro-1-benzofuran-4-one; 7,7-dimethyl-3-phenyl-2-pyridin-4-yl-5,6-dihydro-1-benzofuran-4-one Openeye Name: 7,7-dimethyl-3-phenyl-5,6-dihydrobenzofuran-4-one; 7,7-dimethyl-3-phenyl-2-(4-pyridyl)-5,6-dihydrobenzofuran-4-one CAS Name: 7,7-dimethyl-3-phenyl-5,6-dihydrobenzofuran-4-one; 7,7-dimethyl-3-phenyl-2-pyridin-4-yl-5,6-dihydrobenzofuran-4-one IUPAC Name: 7,7-dimethyl-3-phenyl-5,6-dihydro-1-benzofuran-4-one; 7,7-dimethyl-3-phenyl-2-pyridin-4-yl-5,6-dihydro-1-benzofuran-4-one Traditional Name: 7,7-dimethyl-3-phenyl-5,6-dihydrobenzofuran-4-one; 7,7-dimethyl-3-phenyl-2-(4-pyridyl)-5,6-dihydrobenzofuran-4-one Formula: C37H35NO4 MolecularWeight: 557.6781

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC(=O)C2=C1OC=C2C3=CC=CC=C3)C.CC1(CCC(=O)C2=C1OC(=C2C3=CC=CC=C3)C4=CC=NC=C4)C

Isomeric SMILES

CC1(CCC(=O)C2=C1OC=C2C3=CC=CC=C3)C.CC1(CCC(=O)C2=C1OC(=C2C3=CC=CC=C3)C4=CC=NC=C4)C

InChI

InChI=1S/C21H19NO2.C16H16O2/c1-21(2)11-8-16(23)18-17(14-6-4-3-5-7-14)19(24-20(18)21)15-9-12-22-13-10-15;1-16(2)9-8-13(17)14-12(10-18-15(14)16)11-6-4-3-5-7-11/h3-7,9-10,12-13H,8,11H2,1-2H3;3-7,10H,8-9H2,1-2H3