[(1S)-1-(2-chlorophenyl)-2-[(2-methyl-3-nitro-phenyl)carbonylamino]ethyl]-dimethyl-azanium

Systemtic Name: [(1S)-1-(2-chlorophenyl)-2-[(2-methyl-3-nitro-phenyl)carbonylamino]ethyl]-dimethyl-azanium Openeye Name: [(1S)-1-(2-chlorophenyl)-2-[(2-methyl-3-nitro-benzoyl)amino]ethyl]-dimethyl-ammonium CAS Name: [(1S)-1-(2-chlorophenyl)-2-[[(2-methyl-3-nitrophenyl)-oxomethyl]amino]ethyl]-dimethylammonium IUPAC Name: [(1S)-1-(2-chlorophenyl)-2-[(2-methyl-3-nitrobenzoyl)amino]ethyl]-dimethylazanium Traditional Name: [(1S)-1-(2-chlorophenyl)-2-[(2-methyl-3-nitro-benzoyl)amino]ethyl]-dimethyl-ammonium Formula: C18H21ClN3O3+ MolecularWeight: 362.83064

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NCC(C2=CC=CC=C2Cl)[NH+](C)C

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NC[C@H](C2=CC=CC=C2Cl)[NH+](C)C

InChI

InChI=1S/C18H20ClN3O3/c1-12-13(8-6-10-16(12)22(24)25)18(23)20-11-17(21(2)3)14-7-4-5-9-15(14)19/h4-10,17H,11H2,1-3H3,(H,20,23)/p+1/t17-/m1/s1