6-phenyl-9-[4-[5-(phenylmethyl)sulfinylpentoxy]phenyl]-8,9-dihydro-7H-benzo[7]annulen-2-ol

Systemtic Name: 6-phenyl-9-[4-[5-(phenylmethyl)sulfinylpentoxy]phenyl]-8,9-dihydro-7H-benzo[7]annulen-2-ol Openeye Name: 9-[4-(5-benzylsulfinylpentoxy)phenyl]-6-phenyl-8,9-dihydro-7H-benzo[7]annulen-2-ol CAS Name: 6-phenyl-9-[4-[5-(phenylmethyl)sulfinylpentoxy]phenyl]-8,9-dihydro-7H-benzo[7]annulen-2-ol IUPAC Name: 9-[4-(5-benzylsulfinylpentoxy)phenyl]-6-phenyl-8,9-dihydro-7H-benzo[7]annulen-2-ol Traditional Name: 9-[4-(5-benzylsulfinylpentoxy)phenyl]-6-phenyl-8,9-dihydro-7H-benzocyclohepten-2-ol Formula: C35H36O3S MolecularWeight: 536.72354

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=CC2=C(C1C3=CC=C(C=C3)OCCCCCS(=O)CC4=CC=CC=C4)C=C(C=C2)O)C5=CC=CC=C5

Isomeric SMILES

C1CC(=CC2=C(C1C3=CC=C(C=C3)OCCCCCS(=O)CC4=CC=CC=C4)C=C(C=C2)O)C5=CC=CC=C5

InChI

InChI=1S/C35H36O3S/c36-32-18-14-31-24-30(28-12-6-2-7-13-28)17-21-34(35(31)25-32)29-15-19-33(20-16-29)38-22-8-3-9-23-39(37)26-27-10-4-1-5-11-27/h1-2,4-7,10-16,18-20,24-25,34,36H,3,8-9,17,21-23,26H2