magnesium (5Z)-1-ethanoyl-5-ethylidene-3-octanoyl-4-oxidanylidene-pyrrol-2-olate

Systemtic Name: magnesium (5Z)-1-ethanoyl-5-ethylidene-3-octanoyl-4-oxidanylidene-pyrrol-2-olate Openeye Name: magnesium (5Z)-1-acetyl-5-ethylidene-3-octanoyl-4-oxo-pyrrol-2-olate CAS Name: magnesium (5Z)-1-acetyl-5-ethylidene-4-oxo-3-(1-oxooctyl)-2-pyrrololate IUPAC Name: magnesium (5Z)-1-acetyl-5-ethylidene-3-octanoyl-4-oxopyrrol-2-olate Traditional Name: magnesium (5Z)-1-acetyl-3-caprylyl-5-ethylidene-4-keto-2-pyrrolin-2-olate Formula: C32H44MgN2O8 MolecularWeight: 609.00536

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)C1=C(N(C(=CC)C1=O)C(=O)C)[O-].CCCCCCCC(=O)C1=C(N(C(=CC)C1=O)C(=O)C)[O-].[Mg+2]

Isomeric SMILES

CCCCCCCC(=O)C1=C(N(/C(=C\C)/C1=O)C(=O)C)[O-].CCCCCCCC(=O)C1=C(N(/C(=C\C)/C1=O)C(=O)C)[O-].[Mg+2]

InChI

InChI=1S/2C16H23NO4.Mg/c2*1-4-6-7-8-9-10-13(19)14-15(20)12(5-2)17(11(3)18)16(14)21;/h2*5,21H,4,6-10H2,1-3H3;/q;;+2/p-2/b2*12-5-;