5-[5-(dimethylamino)pentyl]-3-[(1E,5E)-3-oxidanylocta-1,5-dienyl]-1,2,3,3a,4,6a-hexahydropentalen-2-ol

Systemtic Name: 5-[5-(dimethylamino)pentyl]-3-[(1E,5E)-3-oxidanylocta-1,5-dienyl]-1,2,3,3a,4,6a-hexahydropentalen-2-ol Openeye Name: 5-[5-(dimethylamino)pentyl]-3-[(1E,5E)-3-hydroxyocta-1,5-dienyl]-1,2,3,3a,4,6a-hexahydropentalen-2-ol CAS Name: 5-[5-(dimethylamino)pentyl]-3-[(1E,5E)-3-hydroxyocta-1,5-dienyl]-1,2,3,3a,4,6a-hexahydropentalen-2-ol IUPAC Name: 5-[5-(dimethylamino)pentyl]-3-[(1E,5E)-3-hydroxyocta-1,5-dienyl]-1,2,3,3a,4,6a-hexahydropentalen-2-ol Traditional Name: 5-[5-(dimethylamino)pentyl]-3-[(1E,5E)-3-hydroxyocta-1,5-dienyl]-1,2,3,3a,4,6a-hexahydropentalen-2-ol Formula: C23H39NO2 MolecularWeight: 361.56126

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Descriptors Computed from Structure

Canonical SMILES:

CCC=CCC(C=CC1C(CC2C1CC(=C2)CCCCCN(C)C)O)O

Isomeric SMILES

CC/C=C/CC(/C=C/C1C(CC2C1CC(=C2)CCCCCN(C)C)O)O

InChI

InChI=1S/C23H39NO2/c1-4-5-7-11-20(25)12-13-21-22-16-18(15-19(22)17-23(21)26)10-8-6-9-14-24(2)3/h5,7,12-13,15,19-23,25-26H,4,6,8-11,14,16-17H2,1-3H3/b7-5+,13-12+