[3-methyl-5-[3-[(3-methyl-1-phenoxy-butyl)amino]-2-oxidanyl-propoxy]pyridin-4-yl]methanediol

Systemtic Name: [3-methyl-5-[3-[(3-methyl-1-phenoxy-butyl)amino]-2-oxidanyl-propoxy]pyridin-4-yl]methanediol Openeye Name: [3-[2-hydroxy-3-[(3-methyl-1-phenoxy-butyl)amino]propoxy]-5-methyl-4-pyridyl]methanediol CAS Name: [3-[2-hydroxy-3-[(3-methyl-1-phenoxybutyl)amino]propoxy]-5-methyl-4-pyridinyl]methanediol IUPAC Name: [3-[2-hydroxy-3-[(3-methyl-1-phenoxybutyl)amino]propoxy]-5-methylpyridin-4-yl]methanediol Traditional Name: [3-[2-hydroxy-3-[(3-methyl-1-phenoxy-butyl)amino]propoxy]-5-methyl-4-pyridyl]methanediol Formula: C21H30N2O5 MolecularWeight: 390.4733

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=CC(=C1C(O)O)OCC(CNC(CC(C)C)OC2=CC=CC=C2)O

Isomeric SMILES

CC1=CN=CC(=C1C(O)O)OCC(CNC(CC(C)C)OC2=CC=CC=C2)O

InChI

InChI=1S/C21H30N2O5/c1-14(2)9-19(28-17-7-5-4-6-8-17)23-11-16(24)13-27-18-12-22-10-15(3)20(18)21(25)26/h4-8,10,12,14,16,19,21,23-26H,9,11,13H2,1-3H3