ethanedioate; iron(2+); 3-methylaniline

Systemtic Name: ethanedioate; iron(2+); 3-methylaniline Openeye Name: ferrous; 3-methylaniline; oxalate CAS Name: iron(2+); 3-methylaniline; oxalate IUPAC Name: iron(2+); 3-methylaniline; oxalate Traditional Name: ferrous; m-toluidine; oxalate Formula: C16H18FeN2O4 MolecularWeight: 358.17012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N.CC1=CC(=CC=C1)N.C(=O)(C(=O)[O-])[O-].[Fe+2]

Isomeric SMILES

CC1=CC(=CC=C1)N.CC1=CC(=CC=C1)N.C(=O)(C(=O)[O-])[O-].[Fe+2]

InChI

InChI=1S/2C7H9N.C2H2O4.Fe/c2*1-6-3-2-4-7(8)5-6;3-1(4)2(5)6;/h2*2-5H,8H2,1H3;(H,3,4)(H,5,6);/q;;;+2/p-2