4-(2,2-diethyl-4-methoxy-3H-1-benzofuran-7-yl)-4a,5,6,7,8,8a-hexahydro-2H-phthalazin-1-one

Systemtic Name: 4-(2,2-diethyl-4-methoxy-3H-1-benzofuran-7-yl)-4a,5,6,7,8,8a-hexahydro-2H-phthalazin-1-one Openeye Name: 4-(2,2-diethyl-4-methoxy-3H-benzofuran-7-yl)-4a,5,6,7,8,8a-hexahydro-2H-phthalazin-1-one CAS Name: 4-(2,2-diethyl-4-methoxy-3H-benzofuran-7-yl)-4a,5,6,7,8,8a-hexahydro-2H-phthalazin-1-one IUPAC Name: 4-(2,2-diethyl-4-methoxy-3H-1-benzofuran-7-yl)-4a,5,6,7,8,8a-hexahydro-2H-phthalazin-1-one Traditional Name: 4-(2,2-diethyl-4-methoxy-coumaran-7-yl)-4a,5,6,7,8,8a-hexahydro-2H-phthalazin-1-one Formula: C21H28N2O3 MolecularWeight: 356.45862

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CC2=C(C=CC(=C2O1)C3=NNC(=O)C4C3CCCC4)OC)CC

Isomeric SMILES

CCC1(CC2=C(C=CC(=C2O1)C3=NNC(=O)C4C3CCCC4)OC)CC

InChI

InChI=1S/C21H28N2O3/c1-4-21(5-2)12-16-17(25-3)11-10-15(19(16)26-21)18-13-8-6-7-9-14(13)20(24)23-22-18/h10-11,13-14H,4-9,12H2,1-3H3,(H,23,24)