3-(9,9-dihexyl-7-methyl-fluoren-2-yl)-9-methyl-5,7-dihydrobenzo[d][2]benzoxepine

Systemtic Name: 3-(9,9-dihexyl-7-methyl-fluoren-2-yl)-9-methyl-5,7-dihydrobenzo[d][2]benzoxepine Openeye Name: 3-(9,9-dihexyl-7-methyl-fluoren-2-yl)-9-methyl-5,7-dihydrobenzo[d][2]benzoxepine CAS Name: 3-(9,9-dihexyl-7-methyl-2-fluorenyl)-9-methyl-5,7-dihydrobenzo[d][2]benzoxepin IUPAC Name: 3-(9,9-dihexyl-7-methylfluoren-2-yl)-9-methyl-5,7-dihydrobenzo[d][2]benzoxepine Traditional Name: 3-(9,9-dihexyl-7-methyl-fluoren-2-yl)-9-methyl-5,7-dihydrobenzo[d][2]benzoxepin Formula: C41H48O MolecularWeight: 556.81922

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1(C2=C(C=CC(=C2)C)C3=C1C=C(C=C3)C4=CC5=C(C=C4)C6=C(COC5)C=C(C=C6)C)CCCCCC

Isomeric SMILES

CCCCCCC1(C2=C(C=CC(=C2)C)C3=C1C=C(C=C3)C4=CC5=C(C=C4)C6=C(COC5)C=C(C=C6)C)CCCCCC

InChI

InChI=1S/C41H48O/c1-5-7-9-11-21-41(22-12-10-8-6-2)39-24-30(4)14-18-37(39)38-20-16-32(26-40(38)41)31-15-19-36-34(25-31)28-42-27-33-23-29(3)13-17-35(33)36/h13-20,23-26H,5-12,21-22,27-28H2,1-4H3