bismuth(2+); 2-tert-butyl-6-[(3-tert-butyl-5-methyl-2-oxidanyl-phenyl)methyl]-4-methyl-phenol; 2-oxidanidylbenzoate; hydrate

Systemtic Name: bismuth(2+); 2-tert-butyl-6-[(3-tert-butyl-5-methyl-2-oxidanyl-phenyl)methyl]-4-methyl-phenol; 2-oxidanidylbenzoate; hydrate Openeye Name: bismuth(2+); 2-tert-butyl-6-[(3-tert-butyl-2-hydroxy-5-methyl-phenyl)methyl]-4-methyl-phenol; 2-oxidobenzoate; hydrate CAS Name: bismuth(2+); 2-tert-butyl-6-[(3-tert-butyl-2-hydroxy-5-methylphenyl)methyl]-4-methylphenol; 2-oxidobenzoate; hydrate IUPAC Name: bismuth(2+); 2-tert-butyl-6-[(3-tert-butyl-2-hydroxy-5-methylphenyl)methyl]-4-methylphenol; 2-oxidobenzoate; hydrate Traditional Name: bismuth(2+); 2-tert-butyl-6-(3-tert-butyl-2-hydroxy-5-methyl-benzyl)-4-methyl-phenol; 2-oxidobenzoate; hydrate Formula: C30H38BiO6 MolecularWeight: 703.5995

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C(C)(C)C)O)CC2=C(C(=CC(=C2)C)C(C)(C)C)O.C1=CC=C(C(=C1)C(=O)[O-])[O-].O.[Bi+2]

Isomeric SMILES

CC1=CC(=C(C(=C1)C(C)(C)C)O)CC2=C(C(=CC(=C2)C)C(C)(C)C)O.C1=CC=C(C(=C1)C(=O)[O-])[O-].O.[Bi+2]

InChI

InChI=1S/C23H32O2.C7H6O3.Bi.H2O/c1-14-9-16(20(24)18(11-14)22(3,4)5)13-17-10-15(2)12-19(21(17)25)23(6,7)8;8-6-4-2-1-3-5(6)7(9)10;;/h9-12,24-25H,13H2,1-8H3;1-4,8H,(H,9,10);;1H2/q;;+2;/p-2