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

Systemtic Name: cyclopentanecarbaldehyde; 4-cyclopentyl-1-(phenylmethyl)-1,2,3-triazole; iron(2+) Openeye Name: ferrous; 1-benzyl-4-cyclopentyl-triazole; cyclopentanecarbaldehyde CAS Name: cyclopentanecarboxaldehyde; 4-cyclopentyl-1-(phenylmethyl)triazole; iron(2+) IUPAC Name: 1-benzyl-4-cyclopentyltriazole; cyclopentanecarbaldehyde; iron(2+) Traditional Name: ferrous; 1-benzyl-4-cyclopentyl-triazole; cyclopentanecarbaldehyde Formula: C20H17FeN3O+2 MolecularWeight: 371.21348

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C(N=N2)[C]3[CH][CH][CH][CH]3.[CH]1[CH][CH][C]([CH]1)C=O.[Fe+2]

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(N=N2)[C]3[CH][CH][CH][CH]3.[CH]1[CH][CH][C]([CH]1)C=O.[Fe+2]

InChI

InChI=1S/C14H12N3.C6H5O.Fe/c1-2-6-12(7-3-1)10-17-11-14(15-16-17)13-8-4-5-9-13;7-5-6-3-1-2-4-6;/h1-9,11H,10H2;1-5H;/q;;+2