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

Systemtic Name: cyclopentane; (2S)-2-[(3-cyclopentyl-1-phenyl-pyrazol-4-yl)methylamino]-3-oxidanyl-propanoic acid; iron(2+) Openeye Name: ferrous; cyclopentane; (2S)-2-[(3-cyclopentyl-1-phenyl-pyrazol-4-yl)methylamino]-3-hydroxy-propanoic acid CAS Name: cyclopentane; (2S)-2-[(3-cyclopentyl-1-phenyl-4-pyrazolyl)methylamino]-3-hydroxypropanoic acid; iron(2+) IUPAC Name: cyclopentane; (2S)-2-[(3-cyclopentyl-1-phenylpyrazol-4-yl)methylamino]-3-hydroxypropanoic acid; iron(2+) Traditional Name: ferrous; cyclopentane; (2S)-2-[(3-cyclopentyl-1-phenyl-pyrazol-4-yl)methylamino]-3-hydroxy-propionic acid Formula: C23H23FeN3O3+2 MolecularWeight: 445.29202

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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)CNC(CO)C(=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)CN[C@@H](CO)C(=O)O.[CH]1[CH][CH][CH][CH]1.[Fe+2]

InChI

InChI=1S/C18H18N3O3.C5H5.Fe/c22-12-16(18(23)24)19-10-14-11-21(15-8-2-1-3-9-15)20-17(14)13-6-4-5-7-13;1-2-4-5-3-1;/h1-9,11,16,19,22H,10,12H2,(H,23,24);1-5H;/q;;+2/t16-;;/m0../s1