chloranylaluminum; (6Z)-2,4-ditert-butyl-6-[[[(1R,2R)-2-[(3,5-ditert-butyl-2-oxidanyl-phenyl)methyl-methyl-amino]cyclohexyl]amino]methylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: chloranylaluminum; (6Z)-2,4-ditert-butyl-6-[[[(1R,2R)-2-[(3,5-ditert-butyl-2-oxidanyl-phenyl)methyl-methyl-amino]cyclohexyl]amino]methylidene]cyclohexa-2,4-dien-1-one Openeye Name: chloroaluminum; (6Z)-2,4-ditert-butyl-6-[[[(1R,2R)-2-[(3,5-ditert-butyl-2-hydroxy-phenyl)methyl-methyl-amino]cyclohexyl]amino]methylene]cyclohexa-2,4-dien-1-one CAS Name: chloroaluminum; (6Z)-2,4-ditert-butyl-6-[[[(1R,2R)-2-[(3,5-ditert-butyl-2-hydroxyphenyl)methyl-methylamino]cyclohexyl]amino]methylidene]-1-cyclohexa-2,4-dienone IUPAC Name: chloroaluminum; (6Z)-2,4-ditert-butyl-6-[[[(1R,2R)-2-[(3,5-ditert-butyl-2-hydroxyphenyl)methyl-methylamino]cyclohexyl]amino]methylidene]cyclohexa-2,4-dien-1-one Traditional Name: chloroaluminum; (6Z)-2,4-ditert-butyl-6-[[[(1R,2R)-2-[(3,5-ditert-butyl-2-hydroxy-benzyl)-methyl-amino]cyclohexyl]amino]methylene]cyclohexa-2,4-dien-1-one Formula: C37H58AlClN2O2 MolecularWeight: 625.303158

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C(=C1)C(C)(C)C)O)CN(C)C2CCCCC2NC=C3C=C(C=C(C3=O)C(C)(C)C)C(C)(C)C.[Al]Cl

Isomeric SMILES

CC(C)(C)C1=CC(=C(C(=C1)C(C)(C)C)O)CN(C)[C@@H]2CCCC[C@H]2N/C=C\3/C=C(C=C(C3=O)C(C)(C)C)C(C)(C)C.[Al]Cl

InChI

InChI=1S/C37H58N2O2.Al.ClH/c1-34(2,3)26-18-24(32(40)28(20-26)36(7,8)9)22-38-30-16-14-15-17-31(30)39(13)23-25-19-27(35(4,5)6)21-29(33(25)41)37(10,11)12;;/h18-22,30-31,38,41H,14-17,23H2,1-13H3;;1H/q;+1;/p-1/b24-22-;;/t30-,31-;;/m1../s1