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4-[bis(3,6-ditert-butylazulen-1-yl)methyl]phenol

4-[bis(3,6-ditert-butylazulen-1-yl)methyl]phenol

Systemtic Name:4-[bis(3,6-ditert-butylazulen-1-yl)methyl]phenol
Openeye Name:4-[bis(3,6-ditert-butylazulen-1-yl)methyl]phenol
CAS Name:4-[bis(3,6-ditert-butyl-1-azulenyl)methyl]phenol
IUPAC Name:4-[bis(3,6-ditert-butylazulen-1-yl)methyl]phenol
Traditional Name:4-[bis(3,6-ditert-butylazulen-1-yl)methyl]phenol
Formula: C43H52O
MolecularWeight: 584.87238
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C2C(=C(C=C2C(C)(C)C)C(C3=CC=C(C=C3)O)C4=C5C=CC(=CC=C5C(=C4)C(C)(C)C)C(C)(C)C)C=C1


Isomeric SMILES

CC(C)(C)C1=CC=C2C(=C(C=C2C(C)(C)C)C(C3=CC=C(C=C3)O)C4=C5C=CC(=CC=C5C(=C4)C(C)(C)C)C(C)(C)C)C=C1


InChI

InChI=1S/C43H52O/c1-40(2,3)28-15-21-31-33(23-17-28)37(42(7,8)9)25-35(31)39(27-13-19-30(44)20-14-27)36-26-38(43(10,11)12)34-24-18-29(41(4,5)6)16-22-32(34)36/h13-26,39,44H,1-12H3


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