2-methyl-1-(3-phenyl-1,2-oxazol-5-yl)-3-pyrrolidin-1-yl-butan-1-one hydrochloride

Systemtic Name: 2-methyl-1-(3-phenyl-1,2-oxazol-5-yl)-3-pyrrolidin-1-yl-butan-1-one hydrochloride Openeye Name: 2-methyl-1-(3-phenylisoxazol-5-yl)-3-pyrrolidin-1-yl-butan-1-one hydrochloride CAS Name: 2-methyl-1-(3-phenyl-5-isoxazolyl)-3-(1-pyrrolidinyl)-1-butanone hydrochloride IUPAC Name: 2-methyl-1-(3-phenyl-1,2-oxazol-5-yl)-3-pyrrolidin-1-ylbutan-1-one hydrochloride Traditional Name: 2-methyl-1-(3-phenylisoxazol-5-yl)-3-pyrrolidino-butan-1-one hydrochloride Formula: C18H23ClN2O2 MolecularWeight: 334.84042

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(C)N1CCCC1)C(=O)C2=CC(=NO2)C3=CC=CC=C3.Cl

Isomeric SMILES

CC(C(C)N1CCCC1)C(=O)C2=CC(=NO2)C3=CC=CC=C3.Cl

InChI

InChI=1S/C18H22N2O2.ClH/c1-13(14(2)20-10-6-7-11-20)18(21)17-12-16(19-22-17)15-8-4-3-5-9-15;/h3-5,8-9,12-14H,6-7,10-11H2,1-2H3;1H