4-(2-azanylethyl)-5-pyridin-3-yl-1,2-oxazol-3-one hydrochloride

Systemtic Name: 4-(2-azanylethyl)-5-pyridin-3-yl-1,2-oxazol-3-one hydrochloride Openeye Name: 4-(2-aminoethyl)-5-(3-pyridyl)isoxazol-3-one hydrochloride CAS Name: 4-(2-aminoethyl)-5-(3-pyridinyl)-3-isoxazolone hydrochloride IUPAC Name: 4-(2-aminoethyl)-5-pyridin-3-yl-1,2-oxazol-3-one hydrochloride Traditional Name: 4-(2-aminoethyl)-5-(3-pyridyl)-4-isoxazolin-3-one hydrochloride Formula: C10H12ClN3O2 MolecularWeight: 241.67418

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C2=C(C(=O)NO2)CCN.Cl

Isomeric SMILES

C1=CC(=CN=C1)C2=C(C(=O)NO2)CCN.Cl

InChI

InChI=1S/C10H11N3O2.ClH/c11-4-3-8-9(15-13-10(8)14)7-2-1-5-12-6-7;/h1-2,5-6H,3-4,11H2,(H,13,14);1H