3-cyclohexyl-1-[[4-(2-hydroxyethyl)piperazin-1-yl]methyl]-3,4-dihydro-1H-isochromene-5,6-diol

Systemtic Name: 3-cyclohexyl-1-[[4-(2-hydroxyethyl)piperazin-1-yl]methyl]-3,4-dihydro-1H-isochromene-5,6-diol Openeye Name: 3-cyclohexyl-1-[[4-(2-hydroxyethyl)piperazin-1-yl]methyl]isochromane-5,6-diol CAS Name: 3-cyclohexyl-1-[[4-(2-hydroxyethyl)-1-piperazinyl]methyl]-3,4-dihydro-1H-2-benzopyran-5,6-diol IUPAC Name: 3-cyclohexyl-1-[[4-(2-hydroxyethyl)piperazin-1-yl]methyl]-3,4-dihydro-1H-isochromene-5,6-diol Traditional Name: 3-cyclohexyl-1-[[4-(2-hydroxyethyl)piperazino]methyl]isochroman-5,6-diol Formula: C22H34N2O4 MolecularWeight: 390.51636

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2CC3=C(C=CC(=C3O)O)C(O2)CN4CCN(CC4)CCO

Isomeric SMILES

C1CCC(CC1)C2CC3=C(C=CC(=C3O)O)C(O2)CN4CCN(CC4)CCO

InChI

InChI=1S/C22H34N2O4/c25-13-12-23-8-10-24(11-9-23)15-21-17-6-7-19(26)22(27)18(17)14-20(28-21)16-4-2-1-3-5-16/h6-7,16,20-21,25-27H,1-5,8-15H2