3-cyclohexyl-1-[(4-oxidanylpiperidin-1-yl)methyl]-3,4-dihydro-1H-isochromene-5,6-diol

Systemtic Name: 3-cyclohexyl-1-[(4-oxidanylpiperidin-1-yl)methyl]-3,4-dihydro-1H-isochromene-5,6-diol Openeye Name: 3-cyclohexyl-1-[(4-hydroxy-1-piperidyl)methyl]isochromane-5,6-diol CAS Name: 3-cyclohexyl-1-[(4-hydroxy-1-piperidinyl)methyl]-3,4-dihydro-1H-2-benzopyran-5,6-diol IUPAC Name: 3-cyclohexyl-1-[(4-hydroxypiperidin-1-yl)methyl]-3,4-dihydro-1H-isochromene-5,6-diol Traditional Name: 3-cyclohexyl-1-[(4-hydroxypiperidino)methyl]isochroman-5,6-diol Formula: C21H31NO4 MolecularWeight: 361.47514

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2CC3=C(C=CC(=C3O)O)C(O2)CN4CCC(CC4)O

Isomeric SMILES

C1CCC(CC1)C2CC3=C(C=CC(=C3O)O)C(O2)CN4CCC(CC4)O

InChI

InChI=1S/C21H31NO4/c23-15-8-10-22(11-9-15)13-20-16-6-7-18(24)21(25)17(16)12-19(26-20)14-4-2-1-3-5-14/h6-7,14-15,19-20,23-25H,1-5,8-13H2