cyclopentanecarbaldehyde; 4-cyclopentyl-1-pentyl-1,2,3-triazole; iron(2+)

Systemtic Name: cyclopentanecarbaldehyde; 4-cyclopentyl-1-pentyl-1,2,3-triazole; iron(2+) Openeye Name: ferrous; cyclopentanecarbaldehyde; 4-cyclopentyl-1-pentyl-triazole CAS Name: cyclopentanecarboxaldehyde; 4-cyclopentyl-1-pentyltriazole; iron(2+) IUPAC Name: cyclopentanecarbaldehyde; 4-cyclopentyl-1-pentyltriazole; iron(2+) Traditional Name: ferrous; 1-amyl-4-cyclopentyl-triazole; cyclopentanecarbaldehyde Formula: C18H21FeN3O+2 MolecularWeight: 351.22384

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C=C(N=N1)[C]2[CH][CH][CH][CH]2.[CH]1[CH][CH][C]([CH]1)C=O.[Fe+2]

Isomeric SMILES

CCCCCN1C=C(N=N1)[C]2[CH][CH][CH][CH]2.[CH]1[CH][CH][C]([CH]1)C=O.[Fe+2]

InChI

InChI=1S/C12H16N3.C6H5O.Fe/c1-2-3-6-9-15-10-12(13-14-15)11-7-4-5-8-11;7-5-6-3-1-2-4-6;/h4-5,7-8,10H,2-3,6,9H2,1H3;1-5H;/q;;+2