cyclopentane; 2-[(3-cyclopentyl-1-phenyl-pyrazol-4-yl)methylamino]ethanoic acid; iron(2+)

Systemtic Name: cyclopentane; 2-[(3-cyclopentyl-1-phenyl-pyrazol-4-yl)methylamino]ethanoic acid; iron(2+) Openeye Name: ferrous; cyclopentane; 2-[(3-cyclopentyl-1-phenyl-pyrazol-4-yl)methylamino]acetic acid CAS Name: cyclopentane; 2-[(3-cyclopentyl-1-phenyl-4-pyrazolyl)methylamino]acetic acid; iron(2+) IUPAC Name: cyclopentane; 2-[(3-cyclopentyl-1-phenylpyrazol-4-yl)methylamino]acetic acid; iron(2+) Traditional Name: ferrous; cyclopentane; 2-[(3-cyclopentyl-1-phenyl-pyrazol-4-yl)methylamino]acetic acid Formula: C22H21FeN3O2+2 MolecularWeight: 415.26604

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C(=N2)[C]3[CH][CH][CH][CH]3)CNCC(=O)O.[CH]1[CH][CH][CH][CH]1.[Fe+2]

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=N2)[C]3[CH][CH][CH][CH]3)CNCC(=O)O.[CH]1[CH][CH][CH][CH]1.[Fe+2]

InChI

InChI=1S/C17H16N3O2.C5H5.Fe/c21-16(22)11-18-10-14-12-20(15-8-2-1-3-9-15)19-17(14)13-6-4-5-7-13;1-2-4-5-3-1;/h1-9,12,18H,10-11H2,(H,21,22);1-5H;/q;;+2