1,2-dicyclopropyl-4-pyridin-3-yl-3-[(2-pyridin-3-ylcyclohexyl)methyl]butane-1,2-diol

Systemtic Name: 1,2-dicyclopropyl-4-pyridin-3-yl-3-[(2-pyridin-3-ylcyclohexyl)methyl]butane-1,2-diol Openeye Name: 1,2-dicyclopropyl-4-(3-pyridyl)-3-[[2-(3-pyridyl)cyclohexyl]methyl]butane-1,2-diol CAS Name: 1,2-dicyclopropyl-4-(3-pyridinyl)-3-[[2-(3-pyridinyl)cyclohexyl]methyl]butane-1,2-diol IUPAC Name: 1,2-dicyclopropyl-4-pyridin-3-yl-3-[(2-pyridin-3-ylcyclohexyl)methyl]butane-1,2-diol Traditional Name: 1,2-dicyclopropyl-4-(3-pyridyl)-3-[[2-(3-pyridyl)cyclohexyl]methyl]butane-1,2-diol Formula: C27H36N2O2 MolecularWeight: 420.58694

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)CC(CC2=CN=CC=C2)C(C3CC3)(C(C4CC4)O)O)C5=CN=CC=C5

Isomeric SMILES

C1CCC(C(C1)CC(CC2=CN=CC=C2)C(C3CC3)(C(C4CC4)O)O)C5=CN=CC=C5

InChI

InChI=1S/C27H36N2O2/c30-26(20-9-10-20)27(31,23-11-12-23)24(15-19-5-3-13-28-17-19)16-21-6-1-2-8-25(21)22-7-4-14-29-18-22/h3-5,7,13-14,17-18,20-21,23-26,30-31H,1-2,6,8-12,15-16H2