N-butyl-1-[3-(2-cyclopentylphenyl)-1-phenyl-pyrazol-4-yl]methanimine; cyclopentane; iron(2+)

Systemtic Name: N-butyl-1-[3-(2-cyclopentylphenyl)-1-phenyl-pyrazol-4-yl]methanimine; cyclopentane; iron(2+) Openeye Name: ferrous; N-butyl-1-[3-(2-cyclopentylphenyl)-1-phenyl-pyrazol-4-yl]methanimine; cyclopentane CAS Name: N-butyl-1-[3-(2-cyclopentylphenyl)-1-phenyl-4-pyrazolyl]methanimine; cyclopentane; iron(2+) IUPAC Name: N-butyl-1-[3-(2-cyclopentylphenyl)-1-phenylpyrazol-4-yl]methanimine; cyclopentane; iron(2+) Traditional Name: ferrous; butyl-[[3-(2-cyclopentylphenyl)-1-phenyl-pyrazol-4-yl]methylene]amine; cyclopentane Formula: C30H29FeN3+2 MolecularWeight: 487.41636

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN=CC1=CN(N=C1C2=CC=CC=C2[C]3[CH][CH][CH][CH]3)C4=CC=CC=C4.[CH]1[CH][CH][CH][CH]1.[Fe+2]

Isomeric SMILES

CCCCN=CC1=CN(N=C1C2=CC=CC=C2[C]3[CH][CH][CH][CH]3)C4=CC=CC=C4.[CH]1[CH][CH][CH][CH]1.[Fe+2]

InChI

InChI=1S/C25H24N3.C5H5.Fe/c1-2-3-17-26-18-21-19-28(22-13-5-4-6-14-22)27-25(21)24-16-10-9-15-23(24)20-11-7-8-12-20;1-2-4-5-3-1;/h4-16,18-19H,2-3,17H2,1H3;1-5H;/q;;+2