sodium; cyclopentane; (2S)-2-(cyclopentylmethylideneamino)-3-phenylmethoxy-propanoate; iron(2+)

Systemtic Name: sodium; cyclopentane; (2S)-2-(cyclopentylmethylideneamino)-3-phenylmethoxy-propanoate; iron(2+) Openeye Name: ferrous; sodium; (2S)-3-benzyloxy-2-(cyclopentylmethyleneamino)propanoate; cyclopentane CAS Name: sodium; cyclopentane; (2S)-2-(cyclopentylmethylideneamino)-3-phenylmethoxypropanoate; iron(2+) IUPAC Name: sodium; cyclopentane; (2S)-2-(cyclopentylmethylideneamino)-3-phenylmethoxypropanoate; iron(2+) Traditional Name: ferrous; sodium; (2S)-3-benzoxy-2-(cyclopentylmethyleneamino)propionate; cyclopentane Formula: C21H20FeNNaO3+2 MolecularWeight: 413.22317

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COCC(C(=O)[O-])N=C[C]2[CH][CH][CH][CH]2.[CH]1[CH][CH][CH][CH]1.[Na+].[Fe+2]

Isomeric SMILES

C1=CC=C(C=C1)COC[C@@H](C(=O)[O-])N=C[C]2[CH][CH][CH][CH]2.[CH]1[CH][CH][CH][CH]1.[Na+].[Fe+2]

InChI

InChI=1S/C16H16NO3.C5H5.Fe.Na/c18-16(19)15(17-10-13-6-4-5-7-13)12-20-11-14-8-2-1-3-9-14;1-2-4-5-3-1;;/h1-10,15H,11-12H2,(H,18,19);1-5H;;/q;;+2;+1/p-1/t15-;;;/m0.../s1