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cyclopenta-2,4-dien-1-ylidene-[(2-oxidanylideneazepan-3-yl)amino]methanolate; iron(2+)

cyclopenta-2,4-dien-1-ylidene-[(2-oxidanylideneazepan-3-yl)amino]methanolate; iron(2+)

Systemtic Name:cyclopenta-2,4-dien-1-ylidene-[(2-oxidanylideneazepan-3-yl)amino]methanolate; iron(2+)
Openeye Name:ferrous cyclopenta-2,4-dien-1-ylidene-[(2-oxoazepan-3-yl)amino]methanolate
CAS Name:1-cyclopenta-2,4-dienylidene-[(2-oxo-3-azepanyl)amino]methanolate; iron(2+)
IUPAC Name:cyclopenta-2,4-dien-1-ylidene-[(2-oxoazepan-3-yl)amino]methanolate; iron(2+)
Traditional Name:ferrous cyclopenta-2,4-dien-1-ylidene-[(2-ketoazepan-3-yl)amino]methanolate
Formula: C24H30FeN4O4
MolecularWeight: 494.3644
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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)NC(=C2C=CC=C2)[O-].C1CCNC(=O)C(C1)NC(=C2C=CC=C2)[O-].[Fe+2]


Isomeric SMILES

C1CCNC(=O)C(C1)NC(=C2C=CC=C2)[O-].C1CCNC(=O)C(C1)NC(=C2C=CC=C2)[O-].[Fe+2]


InChI

InChI=1S/2C12H16N2O2.Fe/c2*15-11(9-5-1-2-6-9)14-10-7-3-4-8-13-12(10)16;/h2*1-2,5-6,10,14-15H,3-4,7-8H2,(H,13,16);/q;;+2/p-2


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