azane; cyclopropane; dimethyl-[2-[(4-nitrophenyl)amino]-2-oxidanylidene-ethyl]azanium; chloride

Systemtic Name: azane; cyclopropane; dimethyl-[2-[(4-nitrophenyl)amino]-2-oxidanylidene-ethyl]azanium; chloride Openeye Name: ammonia; cyclopropane; dimethyl-[2-(4-nitroanilino)-2-oxo-ethyl]ammonium; chloride CAS Name: ammonia; cyclopropane; dimethyl-[2-(4-nitroanilino)-2-oxoethyl]ammonium; chloride IUPAC Name: azane; cyclopropane; dimethyl-[2-(4-nitroanilino)-2-oxoethyl]azanium; chloride Traditional Name: ammonia; cyclopropane; [2-keto-2-(4-nitroanilino)ethyl]-dimethyl-ammonium; chloride Formula: C13H23ClN4O3 MolecularWeight: 318.79972

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC(=O)NC1=CC=C(C=C1)[N+](=O)[O-].C1CC1.N.[Cl-]

Isomeric SMILES

C[NH+](C)CC(=O)NC1=CC=C(C=C1)[N+](=O)[O-].C1CC1.N.[Cl-]

InChI

InChI=1S/C10H13N3O3.C3H6.ClH.H3N/c1-12(2)7-10(14)11-8-3-5-9(6-4-8)13(15)16;1-2-3-1;;/h3-6H,7H2,1-2H3,(H,11,14);1-3H2;1H;1H3