cyclopenta-1,3-diene; 4-cyclopenta-2,4-dien-1-yl-6-(4-methoxyphenyl)-3-methyl-1,4-dihydropyrimidin-2-one; iron

Systemtic Name: cyclopenta-1,3-diene; 4-cyclopenta-2,4-dien-1-yl-6-(4-methoxyphenyl)-3-methyl-1,4-dihydropyrimidin-2-one; iron Openeye Name: cyclopenta-1,3-diene; 4-cyclopenta-2,4-dien-1-yl-6-(4-methoxyphenyl)-3-methyl-1,4-dihydropyrimidin-2-one; iron CAS Name: cyclopenta-1,3-diene; 4-(1-cyclopenta-2,4-dienyl)-6-(4-methoxyphenyl)-3-methyl-1,4-dihydropyrimidin-2-one; iron IUPAC Name: cyclopenta-1,3-diene; 4-cyclopenta-2,4-dien-1-yl-6-(4-methoxyphenyl)-3-methyl-1,4-dihydropyrimidin-2-one; iron Traditional Name: cyclopenta-1,3-diene; 4-cyclopenta-2,4-dien-1-yl-6-(4-methoxyphenyl)-3-methyl-1,4-dihydropyrimidin-2-one; iron Formula: C22H22FeN2O2-2 MolecularWeight: 402.26728

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(C=C(NC1=O)C2=CC=C(C=C2)OC)[C-]3C=CC=C3.[CH-]1C=CC=C1.[Fe]

Isomeric SMILES

CN1C(C=C(NC1=O)C2=CC=C(C=C2)OC)[C-]3C=CC=C3.[CH-]1C=CC=C1.[Fe]

InChI

InChI=1S/C17H17N2O2.C5H5.Fe/c1-19-16(13-5-3-4-6-13)11-15(18-17(19)20)12-7-9-14(21-2)10-8-12;1-2-4-5-3-1;/h3-11,16H,1-2H3,(H,18,20);1-5H;/q2*-1;