6-(2-adamantyl)-2-[5-(2-adamantyl)-2,3-dimethyl-6-oxidanyl-phenyl]-3,4-dimethyl-phenol; 2,6-di(propan-2-yl)aniline; (2-methyl-2-phenyl-propylidene)molybdenum(4+)

Systemtic Name: 6-(2-adamantyl)-2-[5-(2-adamantyl)-2,3-dimethyl-6-oxidanyl-phenyl]-3,4-dimethyl-phenol; 2,6-di(propan-2-yl)aniline; (2-methyl-2-phenyl-propylidene)molybdenum(4+) Openeye Name: 6-(2-adamantyl)-2-[3-(2-adamantyl)-2-hydroxy-5,6-dimethyl-phenyl]-3,4-dimethyl-phenol; 2,6-diisopropylaniline; (2-methyl-2-phenyl-propylidene)molybdenum(4+) CAS Name: 6-(2-adamantyl)-2-[3-(2-adamantyl)-2-hydroxy-5,6-dimethylphenyl]-3,4-dimethylphenol; 2,6-di(propan-2-yl)aniline; (2-methyl-2-phenylpropylidene)molybdenum(4+) IUPAC Name: 6-(2-adamantyl)-2-[3-(2-adamantyl)-2-hydroxy-5,6-dimethylphenyl]-3,4-dimethylphenol; 2,6-di(propan-2-yl)aniline; (2-methyl-2-phenylpropylidene)molybdenum(4+) Traditional Name: 6-(2-adamantyl)-2-[3-(2-adamantyl)-2-hydroxy-5,6-dimethyl-phenyl]-3,4-dimethyl-phenol; (2,6-diisopropylphenyl)amine; (2-methyl-2-phenyl-propylidene)molybdenum(4+) Formula: C58H77MoNO2+4 MolecularWeight: 916.17748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1)C2C3CC4CC(C3)CC2C4)O)C5=C(C(=CC(=C5C)C)C6C7CC8CC(C7)CC6C8)O)C.CC(C)C1=C(C(=CC=C1)C(C)C)N.CC(C)(C=[Mo+4])C1=CC=CC=C1

Isomeric SMILES

CC1=C(C(=C(C(=C1)C2C3CC4CC(C3)CC2C4)O)C5=C(C(=CC(=C5C)C)C6C7CC8CC(C7)CC6C8)O)C.CC(C)C1=C(C(=CC=C1)C(C)C)N.CC(C)(C=[Mo+4])C1=CC=CC=C1

InChI

InChI=1S/C36H46O2.C12H19N.C10H12.Mo/c1-17-5-29(33-25-9-21-7-22(11-25)12-26(33)10-21)35(37)31(19(17)3)32-20(4)18(2)6-30(36(32)38)34-27-13-23-8-24(15-27)16-28(34)14-23;1-8(2)10-6-5-7-11(9(3)4)12(10)13;1-10(2,3)9-7-5-4-6-8-9;/h5-6,21-28,33-34,37-38H,7-16H2,1-4H3;5-9H,13H2,1-4H3;1,4-8H,2-3H3;/q;;;+4