cyclopentane; iron(2+); methyl (2S)-2-[2-(3-cyclopentyl-3-oxidanylidene-propyl)sulfanylethanoylamino]-3-oxidanyl-propanoate

Systemtic Name: cyclopentane; iron(2+); methyl (2S)-2-[2-(3-cyclopentyl-3-oxidanylidene-propyl)sulfanylethanoylamino]-3-oxidanyl-propanoate Openeye Name: ferrous; cyclopentane; methyl (2S)-2-[[2-(3-cyclopentyl-3-oxo-propyl)sulfanylacetyl]amino]-3-hydroxy-propanoate CAS Name: cyclopentane; (2S)-2-[[2-[(3-cyclopentyl-3-oxopropyl)thio]-1-oxoethyl]amino]-3-hydroxypropanoic acid methyl ester; iron(2+) IUPAC Name: cyclopentane; iron(2+); methyl (2S)-2-[[2-(3-cyclopentyl-3-oxopropyl)sulfanylacetyl]amino]-3-hydroxypropanoate Traditional Name: ferrous; cyclopentane; (2S)-2-[[2-[(3-cyclopentyl-3-keto-propyl)thio]acetyl]amino]-3-hydroxy-propionic acid methyl ester Formula: C19H23FeNO5S+2 MolecularWeight: 433.29962

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CO)NC(=O)CSCCC(=O)[C]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[Fe+2]

Isomeric SMILES

COC(=O)[C@H](CO)NC(=O)CSCCC(=O)[C]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[Fe+2]

InChI

InChI=1S/C14H18NO5S.C5H5.Fe/c1-20-14(19)11(8-16)15-13(18)9-21-7-6-12(17)10-4-2-3-5-10;1-2-4-5-3-1;/h2-5,11,16H,6-9H2,1H3,(H,15,18);1-5H;/q;;+2/t11-;;/m0../s1