N2,N3-bis[2,6-di(propan-2-yl)phenyl]butane-2,3-diimine; cyclooctane; iron

Systemtic Name: N2,N3-bis[2,6-di(propan-2-yl)phenyl]butane-2,3-diimine; cyclooctane; iron Openeye Name: N2,N3-bis(2,6-diisopropylphenyl)butane-2,3-diimine; cyclooctane; iron CAS Name: N2,N3-bis[2,6-di(propan-2-yl)phenyl]butane-2,3-diimine; cyclooctane; iron IUPAC Name: 2-N,3-N-bis[2,6-di(propan-2-yl)phenyl]butane-2,3-diimine; cyclooctane; iron Traditional Name: cyclooctane; (2,6-diisopropylphenyl)-[2-(2,6-diisopropylphenyl)imino-1-methyl-propylidene]amine; iron Formula: C36H52FeN2 MolecularWeight: 568.65648

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=CC=C1)C(C)C)N=C(C)C(=NC2=C(C=CC=C2C(C)C)C(C)C)C.C1C[CH][CH]CC[CH][CH]1.[Fe]

Isomeric SMILES

CC(C)C1=C(C(=CC=C1)C(C)C)N=C(C)C(=NC2=C(C=CC=C2C(C)C)C(C)C)C.C1C[CH][CH]CC[CH][CH]1.[Fe]

InChI

InChI=1S/C28H40N2.C8H12.Fe/c1-17(2)23-13-11-14-24(18(3)4)27(23)29-21(9)22(10)30-28-25(19(5)6)15-12-16-26(28)20(7)8;1-2-4-6-8-7-5-3-1;/h11-20H,1-10H3;1-2,7-8H,3-6H2;