cyclopentyl-naphthalen-1-yl-phenyl-methanol; iron(2+)

Systemtic Name: cyclopentyl-naphthalen-1-yl-phenyl-methanol; iron(2+) Openeye Name: ferrous cyclopentyl-(1-naphthyl)-phenyl-methanol CAS Name: cyclopentyl-(1-naphthalenyl)-phenylmethanol; iron(2+) IUPAC Name: cyclopentyl-naphthalen-1-yl-phenylmethanol; iron(2+) Traditional Name: ferrous cyclopentyl-(1-naphthyl)-phenyl-methanol Formula: C44H34FeO2+2 MolecularWeight: 650.58456

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC3=CC=CC=C32)([C]4[CH][CH][CH][CH]4)O.C1=CC=C(C=C1)C(C2=CC=CC3=CC=CC=C32)([C]4[CH][CH][CH][CH]4)O.[Fe+2]

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC3=CC=CC=C32)([C]4[CH][CH][CH][CH]4)O.C1=CC=C(C=C1)C(C2=CC=CC3=CC=CC=C32)([C]4[CH][CH][CH][CH]4)O.[Fe+2]

InChI

InChI=1S/2C22H17O.Fe/c2*23-22(19-13-5-6-14-19,18-11-2-1-3-12-18)21-16-8-10-17-9-4-7-15-20(17)21;/h2*1-16,23H;/q;;+2