[3-[(2-chloranyl-4,6-dimethyl-phenyl)-methyl-amino]-3-oxidanylidene-propyl]azanium

Systemtic Name: [3-[(2-chloranyl-4,6-dimethyl-phenyl)-methyl-amino]-3-oxidanylidene-propyl]azanium Openeye Name: [3-(2-chloro-N,4,6-trimethyl-anilino)-3-oxo-propyl]ammonium CAS Name: [3-(2-chloro-N,4,6-trimethylanilino)-3-oxopropyl]ammonium IUPAC Name: [3-(2-chloro-N,4,6-trimethylanilino)-3-oxopropyl]azanium Traditional Name: [3-(2-chloro-N,4,6-trimethyl-anilino)-3-keto-propyl]ammonium Formula: C12H18ClN2O+ MolecularWeight: 241.73712

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Cl)N(C)C(=O)CC[NH3+])C

Isomeric SMILES

CC1=CC(=C(C(=C1)Cl)N(C)C(=O)CC[NH3+])C

InChI

InChI=1S/C12H17ClN2O/c1-8-6-9(2)12(10(13)7-8)15(3)11(16)4-5-14/h6-7H,4-5,14H2,1-3H3/p+1