cyclopenta-1,3-diene; (Z)-4-cyclopenta-1,3-dien-1-yl-4-oxidanyl-2-oxidanylidene-but-3-enoic acid; iron(2+)

Systemtic Name: cyclopenta-1,3-diene; (Z)-4-cyclopenta-1,3-dien-1-yl-4-oxidanyl-2-oxidanylidene-but-3-enoic acid; iron(2+) Openeye Name: ferrous; cyclopenta-1,3-diene; (Z)-4-cyclopenta-1,3-dien-1-yl-4-hydroxy-2-oxo-but-3-enoic acid CAS Name: cyclopenta-1,3-diene; (Z)-4-(1-cyclopenta-1,3-dienyl)-4-hydroxy-2-oxo-3-butenoic acid; iron(2+) IUPAC Name: cyclopenta-1,3-diene; (Z)-4-cyclopenta-1,3-dien-1-yl-4-hydroxy-2-oxobut-3-enoic acid; iron(2+) Traditional Name: ferrous; cyclopenta-1,3-diene; (Z)-4-cyclopenta-1,3-dien-1-yl-4-hydroxy-2-keto-but-3-enoic acid Formula: C14H14FeO4+2 MolecularWeight: 302.10356

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CC=C1.C1C=CC=C1C(=CC(=O)C(=O)O)O.[Fe+2]

Isomeric SMILES

C1C=CC=C1.C1C=CC=C1/C(=C/C(=O)C(=O)O)/O.[Fe+2]

InChI

InChI=1S/C9H8O4.C5H6.Fe/c10-7(5-8(11)9(12)13)6-3-1-2-4-6;1-2-4-5-3-1;/h1-3,5,10H,4H2,(H,12,13);1-4H,5H2;/q;;+2/b7-5-;;