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

Systemtic Name: [3-methyl-5-[3-[[3-methyl-1-(3-methylphenoxy)butyl]amino]-2-oxidanyl-propoxy]pyridin-4-yl]methanediol Openeye Name: [3-[2-hydroxy-3-[[3-methyl-1-(3-methylphenoxy)butyl]amino]propoxy]-5-methyl-4-pyridyl]methanediol CAS Name: [3-[2-hydroxy-3-[[3-methyl-1-(3-methylphenoxy)butyl]amino]propoxy]-5-methyl-4-pyridinyl]methanediol IUPAC Name: [3-[2-hydroxy-3-[[3-methyl-1-(3-methylphenoxy)butyl]amino]propoxy]-5-methylpyridin-4-yl]methanediol Traditional Name: [3-[2-hydroxy-3-[[3-methyl-1-(3-methylphenoxy)butyl]amino]propoxy]-5-methyl-4-pyridyl]methanediol Formula: C22H32N2O5 MolecularWeight: 404.49988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OC(CC(C)C)NCC(COC2=C(C(=CN=C2)C)C(O)O)O

Isomeric SMILES

CC1=CC(=CC=C1)OC(CC(C)C)NCC(COC2=C(C(=CN=C2)C)C(O)O)O

InChI

InChI=1S/C22H32N2O5/c1-14(2)8-20(29-18-7-5-6-15(3)9-18)24-11-17(25)13-28-19-12-23-10-16(4)21(19)22(26)27/h5-7,9-10,12,14,17,20,22,24-27H,8,11,13H2,1-4H3