cyclopentane; 2-cyclopentyl-2-(4-methoxyphenyl)phenanthro[9,10-b]pyran; iron(2+)

Systemtic Name: cyclopentane; 2-cyclopentyl-2-(4-methoxyphenyl)phenanthro[9,10-b]pyran; iron(2+) Openeye Name: ferrous; cyclopentane; 2-cyclopentyl-2-(4-methoxyphenyl)phenanthro[9,10-b]pyran CAS Name: cyclopentane; 2-cyclopentyl-2-(4-methoxyphenyl)phenanthro[9,10-b]pyran; iron(2+) IUPAC Name: cyclopentane; 2-cyclopentyl-2-(4-methoxyphenyl)phenanthro[9,10-b]pyran; iron(2+) Traditional Name: ferrous; cyclopentane; 2-cyclopentyl-2-(4-methoxyphenyl)phenanthro[9,10-b]pyran Formula: C34H26FeO2+2 MolecularWeight: 522.41404

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2(C=CC3=C(O2)C4=CC=CC=C4C5=CC=CC=C35)[C]6[CH][CH][CH][CH]6.[CH]1[CH][CH][CH][CH]1.[Fe+2]

Isomeric SMILES

COC1=CC=C(C=C1)C2(C=CC3=C(O2)C4=CC=CC=C4C5=CC=CC=C35)[C]6[CH][CH][CH][CH]6.[CH]1[CH][CH][CH][CH]1.[Fe+2]

InChI

InChI=1S/C29H21O2.C5H5.Fe/c1-30-22-16-14-21(15-17-22)29(20-8-2-3-9-20)19-18-27-25-12-5-4-10-23(25)24-11-6-7-13-26(24)28(27)31-29;1-2-4-5-3-1;/h2-19H,1H3;1-5H;/q;;+2