5-(1,3-benzodioxol-5-yl)-3-cyclopentyl-2,6-diphenyl-cyclohex-2-en-1-one; cyclopentane; iron(2+)

Systemtic Name: 5-(1,3-benzodioxol-5-yl)-3-cyclopentyl-2,6-diphenyl-cyclohex-2-en-1-one; cyclopentane; iron(2+) Openeye Name: ferrous; 5-(1,3-benzodioxol-5-yl)-3-cyclopentyl-2,6-diphenyl-cyclohex-2-en-1-one; cyclopentane CAS Name: 5-(1,3-benzodioxol-5-yl)-3-cyclopentyl-2,6-diphenyl-1-cyclohex-2-enone; cyclopentane; iron(2+) IUPAC Name: 5-(1,3-benzodioxol-5-yl)-3-cyclopentyl-2,6-diphenylcyclohex-2-en-1-one; cyclopentane; iron(2+) Traditional Name: ferrous; 5-(1,3-benzodioxol-5-yl)-3-cyclopentyl-2,6-diphenyl-cyclohex-2-en-1-one; cyclopentane Formula: C35H28FeO3+2 MolecularWeight: 552.44002

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(C(=O)C(=C1[C]2[CH][CH][CH][CH]2)C3=CC=CC=C3)C4=CC=CC=C4)C5=CC6=C(C=C5)OCO6.[CH]1[CH][CH][CH][CH]1.[Fe+2]

Isomeric SMILES

C1C(C(C(=O)C(=C1[C]2[CH][CH][CH][CH]2)C3=CC=CC=C3)C4=CC=CC=C4)C5=CC6=C(C=C5)OCO6.[CH]1[CH][CH][CH][CH]1.[Fe+2]

InChI

InChI=1S/C30H23O3.C5H5.Fe/c31-30-28(21-11-3-1-4-12-21)24(20-9-7-8-10-20)18-25(29(30)22-13-5-2-6-14-22)23-15-16-26-27(17-23)33-19-32-26;1-2-4-5-3-1;/h1-17,25,29H,18-19H2;1-5H;/q;;+2