[4-[(2-chloranylethanoylamino)methyl]phenyl]methyl-dimethyl-azanium

Systemtic Name: [4-[(2-chloranylethanoylamino)methyl]phenyl]methyl-dimethyl-azanium Openeye Name: [4-[[(2-chloroacetyl)amino]methyl]phenyl]methyl-dimethyl-ammonium CAS Name: [4-[[(2-chloro-1-oxoethyl)amino]methyl]phenyl]methyl-dimethylammonium IUPAC Name: [4-[[(2-chloroacetyl)amino]methyl]phenyl]methyl-dimethylazanium Traditional Name: [4-[[(2-chloroacetyl)amino]methyl]benzyl]-dimethyl-ammonium Formula: C12H18ClN2O+ MolecularWeight: 241.73712

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC1=CC=C(C=C1)CNC(=O)CCl

Isomeric SMILES

C[NH+](C)CC1=CC=C(C=C1)CNC(=O)CCl

InChI

InChI=1S/C12H17ClN2O/c1-15(2)9-11-5-3-10(4-6-11)8-14-12(16)7-13/h3-6H,7-9H2,1-2H3,(H,14,16)/p+1