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

Systemtic Name: cyclopentane; (2S)-2-[(3-cyclopentyl-1-phenyl-pyrazol-4-yl)methylamino]-4-methyl-pentanoic acid; iron(2+) Openeye Name: ferrous; cyclopentane; (2S)-2-[(3-cyclopentyl-1-phenyl-pyrazol-4-yl)methylamino]-4-methyl-pentanoic acid CAS Name: cyclopentane; (2S)-2-[(3-cyclopentyl-1-phenyl-4-pyrazolyl)methylamino]-4-methylpentanoic acid; iron(2+) IUPAC Name: cyclopentane; (2S)-2-[(3-cyclopentyl-1-phenylpyrazol-4-yl)methylamino]-4-methylpentanoic acid; iron(2+) Traditional Name: ferrous; cyclopentane; (2S)-2-[(3-cyclopentyl-1-phenyl-pyrazol-4-yl)methylamino]-4-methyl-valeric acid Formula: C26H29FeN3O2+2 MolecularWeight: 471.37236

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)NCC1=CN(N=C1[C]2[CH][CH][CH][CH]2)C3=CC=CC=C3.[CH]1[CH][CH][CH][CH]1.[Fe+2]

Isomeric SMILES

CC(C)C[C@@H](C(=O)O)NCC1=CN(N=C1[C]2[CH][CH][CH][CH]2)C3=CC=CC=C3.[CH]1[CH][CH][CH][CH]1.[Fe+2]

InChI

InChI=1S/C21H24N3O2.C5H5.Fe/c1-15(2)12-19(21(25)26)22-13-17-14-24(18-10-4-3-5-11-18)23-20(17)16-8-6-7-9-16;1-2-4-5-3-1;/h3-11,14-15,19,22H,12-13H2,1-2H3,(H,25,26);1-5H;/q;;+2/t19-;;/m0../s1