carbon monoxide; 6-cyclohexa-2,4-dien-1-yl-4-methoxy-3-methyl-2-phenyl-aniline; iron

Systemtic Name: carbon monoxide; 6-cyclohexa-2,4-dien-1-yl-4-methoxy-3-methyl-2-phenyl-aniline; iron Openeye Name: carbon monoxide; 6-cyclohexa-2,4-dien-1-yl-4-methoxy-3-methyl-2-phenyl-aniline; iron CAS Name: carbon monoxide; 6-(1-cyclohexa-2,4-dienyl)-4-methoxy-3-methyl-2-phenylaniline; iron IUPAC Name: carbon monoxide; 6-cyclohexa-2,4-dien-1-yl-4-methoxy-3-methyl-2-phenylaniline; iron Traditional Name: carbon monoxide; (6-cyclohexa-2,4-dien-1-yl-4-methoxy-3-methyl-2-phenyl-phenyl)amine; iron Formula: C23H21FeNO4 MolecularWeight: 431.26214

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=C1C2=CC=CC=C2)N)C3CC=CC=C3)OC.[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe]

Isomeric SMILES

CC1=C(C=C(C(=C1C2=CC=CC=C2)N)C3CC=CC=C3)OC.[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe]

InChI

InChI=1S/C20H21NO.3CO.Fe/c1-14-18(22-2)13-17(15-9-5-3-6-10-15)20(21)19(14)16-11-7-4-8-12-16;3*1-2;/h3-9,11-13,15H,10,21H2,1-2H3;;;;