6-phenyl-5-[4-[5-(pyridin-2-ylmethylsulfanyl)pentoxy]phenyl]-8,9-dihydro-7H-benzo[7]annulen-2-ol

Systemtic Name: 6-phenyl-5-[4-[5-(pyridin-2-ylmethylsulfanyl)pentoxy]phenyl]-8,9-dihydro-7H-benzo[7]annulen-2-ol Openeye Name: 6-phenyl-5-[4-[5-(2-pyridylmethylsulfanyl)pentoxy]phenyl]-8,9-dihydro-7H-benzo[7]annulen-2-ol CAS Name: 6-phenyl-5-[4-[5-(2-pyridinylmethylthio)pentoxy]phenyl]-8,9-dihydro-7H-benzo[7]annulen-2-ol IUPAC Name: 6-phenyl-5-[4-[5-(pyridin-2-ylmethylsulfanyl)pentoxy]phenyl]-8,9-dihydro-7H-benzo[7]annulen-2-ol Traditional Name: 6-phenyl-5-[4-[5-(2-pyridylmethylthio)pentoxy]phenyl]-8,9-dihydro-7H-benzocyclohepten-2-ol Formula: C34H35NO2S MolecularWeight: 521.7122

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=CC(=C2)O)C(=C(C1)C3=CC=CC=C3)C4=CC=C(C=C4)OCCCCCSCC5=CC=CC=N5

Isomeric SMILES

C1CC2=C(C=CC(=C2)O)C(=C(C1)C3=CC=CC=C3)C4=CC=C(C=C4)OCCCCCSCC5=CC=CC=N5

InChI

InChI=1S/C34H35NO2S/c36-30-17-20-33-28(24-30)12-9-14-32(26-10-3-1-4-11-26)34(33)27-15-18-31(19-16-27)37-22-7-2-8-23-38-25-29-13-5-6-21-35-29/h1,3-6,10-11,13,15-21,24,36H,2,7-9,12,14,22-23,25H2