(1R,3aS,7aR)-2-methylidene-1-pentylsulfanyl-7a-phenylmethoxy-3,3a,4,5,6,7-hexahydro-1H-indene

Systemtic Name: (1R,3aS,7aR)-2-methylidene-1-pentylsulfanyl-7a-phenylmethoxy-3,3a,4,5,6,7-hexahydro-1H-indene Openeye Name: (1R,3aS,7aR)-7a-benzyloxy-2-methylene-1-pentylsulfanyl-3,3a,4,5,6,7-hexahydro-1H-indene CAS Name: (1R,3aS,7aR)-2-methylene-1-(pentylthio)-7a-phenylmethoxy-3,3a,4,5,6,7-hexahydro-1H-indene IUPAC Name: (1R,3aS,7aR)-2-methylidene-1-pentylsulfanyl-7a-phenylmethoxy-3,3a,4,5,6,7-hexahydro-1H-indene Traditional Name: (1R,3aS,7aR)-1-(amylthio)-7a-benzoxy-2-methylene-3,3a,4,5,6,7-hexahydro-1H-indene Formula: C22H32OS MolecularWeight: 344.55388

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCSC1C(=C)CC2C1(CCCC2)OCC3=CC=CC=C3

Isomeric SMILES

CCCCCS[C@@H]1C(=C)C[C@H]2[C@@]1(CCCC2)OCC3=CC=CC=C3

InChI

InChI=1S/C22H32OS/c1-3-4-10-15-24-21-18(2)16-20-13-8-9-14-22(20,21)23-17-19-11-6-5-7-12-19/h5-7,11-12,20-21H,2-4,8-10,13-17H2,1H3/t20-,21+,22+/m0/s1