1-[3-[(2-azanyl-1,6-dimethyl-pyrimidin-1-ium-4-yl)amino]-5-(1-hydroxyethyl)phenyl]ethanol

Systemtic Name: 1-[3-[(2-azanyl-1,6-dimethyl-pyrimidin-1-ium-4-yl)amino]-5-(1-hydroxyethyl)phenyl]ethanol Openeye Name: 1-[3-[(2-amino-1,6-dimethyl-pyrimidin-1-ium-4-yl)amino]-5-(1-hydroxyethyl)phenyl]ethanol CAS Name: 1-[3-[(2-amino-1,6-dimethyl-4-pyrimidin-1-iumyl)amino]-5-(1-hydroxyethyl)phenyl]ethanol IUPAC Name: 1-[3-[(2-amino-1,6-dimethylpyrimidin-1-ium-4-yl)amino]-5-(1-hydroxyethyl)phenyl]ethanol Traditional Name: 1-[3-[(2-amino-1,6-dimethyl-pyrimidin-1-ium-4-yl)amino]-5-(1-hydroxyethyl)phenyl]ethanol Formula: C16H23N4O2+ MolecularWeight: 303.37942

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=[N+]1C)N)NC2=CC(=CC(=C2)C(C)O)C(C)O

Isomeric SMILES

CC1=CC(=NC(=[N+]1C)N)NC2=CC(=CC(=C2)C(C)O)C(C)O

InChI

InChI=1S/C16H22N4O2/c1-9-5-15(19-16(17)20(9)4)18-14-7-12(10(2)21)6-13(8-14)11(3)22/h5-8,10-11,21-22H,1-4H3,(H2,17,18,19)/p+1