[4-[(2-chloranyl-6-methyl-phenyl)carbonylamino]phenyl]methyl-dimethyl-(oxan-4-yl)azanium

Systemtic Name: [4-[(2-chloranyl-6-methyl-phenyl)carbonylamino]phenyl]methyl-dimethyl-(oxan-4-yl)azanium Openeye Name: [4-[(2-chloro-6-methyl-benzoyl)amino]phenyl]methyl-dimethyl-tetrahydropyran-4-yl-ammonium CAS Name: [4-[[(2-chloro-6-methylphenyl)-oxomethyl]amino]phenyl]methyl-dimethyl-(4-oxanyl)ammonium IUPAC Name: [4-[(2-chloro-6-methylbenzoyl)amino]phenyl]methyl-dimethyl-(oxan-4-yl)azanium Traditional Name: [4-[(2-chloro-6-methyl-benzoyl)amino]benzyl]-dimethyl-tetrahydropyran-4-yl-ammonium Formula: C22H28ClN2O2+ MolecularWeight: 387.92292

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)Cl)C(=O)NC2=CC=C(C=C2)C[N+](C)(C)C3CCOCC3

Isomeric SMILES

CC1=C(C(=CC=C1)Cl)C(=O)NC2=CC=C(C=C2)C[N+](C)(C)C3CCOCC3

InChI

InChI=1S/C22H27ClN2O2/c1-16-5-4-6-20(23)21(16)22(26)24-18-9-7-17(8-10-18)15-25(2,3)19-11-13-27-14-12-19/h4-10,19H,11-15H2,1-3H3/p+1