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

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

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