2-[2-hydroxyethyl-[1-(2-methylphenyl)-2-oxidanidyl-pyrazol-2-ium-4-yl]amino]ethanol

Systemtic Name: 2-[2-hydroxyethyl-[1-(2-methylphenyl)-2-oxidanidyl-pyrazol-2-ium-4-yl]amino]ethanol Openeye Name: 2-[2-hydroxyethyl-[1-(o-tolyl)-2-oxido-pyrazol-2-ium-4-yl]amino]ethanol CAS Name: 2-[2-hydroxyethyl-[1-(2-methylphenyl)-2-oxido-4-pyrazol-2-iumyl]amino]ethanol IUPAC Name: 2-[2-hydroxyethyl-[1-(2-methylphenyl)-2-oxidopyrazol-2-ium-4-yl]amino]ethanol Traditional Name: 2-[2-hydroxyethyl-[1-(o-tolyl)-2-oxido-pyrazol-2-ium-4-yl]amino]ethanol Formula: C14H19N3O3 MolecularWeight: 277.31896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C=C(C=[N+]2[O-])N(CCO)CCO

Isomeric SMILES

CC1=CC=CC=C1N2C=C(C=[N+]2[O-])N(CCO)CCO

InChI

InChI=1S/C14H19N3O3/c1-12-4-2-3-5-14(12)16-10-13(11-17(16)20)15(6-8-18)7-9-19/h2-5,10-11,18-19H,6-9H2,1H3