1-(6-methyl-1-oxidanidyl-pyridin-1-ium-3-yl)oxy-3-(propan-2-ylamino)propan-2-ol

Systemtic Name: 1-(6-methyl-1-oxidanidyl-pyridin-1-ium-3-yl)oxy-3-(propan-2-ylamino)propan-2-ol Openeye Name: 1-(isopropylamino)-3-(6-methyl-1-oxido-pyridin-1-ium-3-yl)oxy-propan-2-ol CAS Name: 1-[(6-methyl-1-oxido-3-pyridin-1-iumyl)oxy]-3-(propan-2-ylamino)-2-propanol IUPAC Name: 1-(6-methyl-1-oxidopyridin-1-ium-3-yl)oxy-3-(propan-2-ylamino)propan-2-ol Traditional Name: 1-(isopropylamino)-3-(6-methyl-1-oxido-pyridin-1-ium-3-yl)oxy-propan-2-ol Formula: C12H20N2O3 MolecularWeight: 240.2988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C=C(C=C1)OCC(CNC(C)C)O)[O-]

Isomeric SMILES

CC1=[N+](C=C(C=C1)OCC(CNC(C)C)O)[O-]

InChI

InChI=1S/C12H20N2O3/c1-9(2)13-6-11(15)8-17-12-5-4-10(3)14(16)7-12/h4-5,7,9,11,13,15H,6,8H2,1-3H3