cyclopentane; 3-cyclopentyl-7-methoxy-3,3a,4,5-tetrahydro-2H-benzo[g]indazole; iron(2+)

Systemtic Name: cyclopentane; 3-cyclopentyl-7-methoxy-3,3a,4,5-tetrahydro-2H-benzo[g]indazole; iron(2+) Openeye Name: ferrous; cyclopentane; 3-cyclopentyl-7-methoxy-3,3a,4,5-tetrahydro-2H-benzo[g]indazole CAS Name: cyclopentane; 3-cyclopentyl-7-methoxy-3,3a,4,5-tetrahydro-2H-benzo[g]indazole; iron(2+) IUPAC Name: cyclopentane; 3-cyclopentyl-7-methoxy-3,3a,4,5-tetrahydro-2H-benzo[g]indazole; iron(2+) Traditional Name: ferrous; cyclopentane; 3-cyclopentyl-7-methoxy-3,3a,4,5-tetrahydro-2H-benz[g]indazole Formula: C22H22FeN2O+2 MolecularWeight: 386.26788

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C3=NNC(C3CC2)[C]4[CH][CH][CH][CH]4.[CH]1[CH][CH][CH][CH]1.[Fe+2]

Isomeric SMILES

COC1=CC2=C(C=C1)C3=NNC(C3CC2)[C]4[CH][CH][CH][CH]4.[CH]1[CH][CH][CH][CH]1.[Fe+2]

InChI

InChI=1S/C17H17N2O.C5H5.Fe/c1-20-13-7-9-14-12(10-13)6-8-15-16(18-19-17(14)15)11-4-2-3-5-11;1-2-4-5-3-1;/h2-5,7,9-10,15-16,18H,6,8H2,1H3;1-5H;/q;;+2