(2R)-1-[2-methoxy-5-[[2-(6-methylpyridin-2-yl)ethylamino]methyl]phenoxy]-3-piperidin-1-ium-1-yl-propan-2-ol

Systemtic Name: (2R)-1-[2-methoxy-5-[[2-(6-methylpyridin-2-yl)ethylamino]methyl]phenoxy]-3-piperidin-1-ium-1-yl-propan-2-ol Openeye Name: (2R)-1-[2-methoxy-5-[[2-(6-methyl-2-pyridyl)ethylamino]methyl]phenoxy]-3-piperidin-1-ium-1-yl-propan-2-ol CAS Name: (2R)-1-[2-methoxy-5-[[2-(6-methyl-2-pyridinyl)ethylamino]methyl]phenoxy]-3-(1-piperidin-1-iumyl)-2-propanol IUPAC Name: (2R)-1-[2-methoxy-5-[[2-(6-methylpyridin-2-yl)ethylamino]methyl]phenoxy]-3-piperidin-1-ium-1-ylpropan-2-ol Traditional Name: (2R)-1-[2-methoxy-5-[[2-(6-methyl-2-pyridyl)ethylamino]methyl]phenoxy]-3-piperidin-1-ium-1-yl-propan-2-ol Formula: C24H36N3O3+ MolecularWeight: 414.56094

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC=C1)CCNCC2=CC(=C(C=C2)OC)OCC(C[NH+]3CCCCC3)O

Isomeric SMILES

CC1=NC(=CC=C1)CCNCC2=CC(=C(C=C2)OC)OC[C@@H](C[NH+]3CCCCC3)O

InChI

InChI=1S/C24H35N3O3/c1-19-7-6-8-21(26-19)11-12-25-16-20-9-10-23(29-2)24(15-20)30-18-22(28)17-27-13-4-3-5-14-27/h6-10,15,22,25,28H,3-5,11-14,16-18H2,1-2H3/p+1/t22-/m1/s1