3,5,5-trimethyl-2-(4-nitrophenyl)imidazol-4-one hydrochloride

Systemtic Name: 3,5,5-trimethyl-2-(4-nitrophenyl)imidazol-4-one hydrochloride Openeye Name: 3,5,5-trimethyl-2-(4-nitrophenyl)imidazol-4-one hydrochloride CAS Name: 3,5,5-trimethyl-2-(4-nitrophenyl)-4-imidazolone hydrochloride IUPAC Name: 3,5,5-trimethyl-2-(4-nitrophenyl)imidazol-4-one hydrochloride Traditional Name: 3,5,5-trimethyl-2-(4-nitrophenyl)-2-imidazolin-4-one hydrochloride Formula: C12H14ClN3O3 MolecularWeight: 283.71086

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)N(C(=N1)C2=CC=C(C=C2)[N+](=O)[O-])C)C.Cl

Isomeric SMILES

CC1(C(=O)N(C(=N1)C2=CC=C(C=C2)[N+](=O)[O-])C)C.Cl

InChI

InChI=1S/C12H13N3O3.ClH/c1-12(2)11(16)14(3)10(13-12)8-4-6-9(7-5-8)15(17)18;/h4-7H,1-3H3;1H