N,N-dimethylcarbamate; 4-(1-methylpiperidin-1-ium-1-yl)phenol; bromide

Systemtic Name: N,N-dimethylcarbamate; 4-(1-methylpiperidin-1-ium-1-yl)phenol; bromide Openeye Name: N,N-dimethylcarbamate; 4-(1-methylpiperidin-1-ium-1-yl)phenol; bromide CAS Name: N,N-dimethylcarbamate; 4-(1-methyl-1-piperidin-1-iumyl)phenol; bromide IUPAC Name: N,N-dimethylcarbamate; 4-(1-methylpiperidin-1-ium-1-yl)phenol; bromide Traditional Name: N,N-dimethylcarbamate; 4-(1-methylpiperidin-1-ium-1-yl)phenol; bromide Formula: C15H24BrN2O3- MolecularWeight: 360.26666

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)[O-].C[N+]1(CCCCC1)C2=CC=C(C=C2)O.[Br-]

Isomeric SMILES

CN(C)C(=O)[O-].C[N+]1(CCCCC1)C2=CC=C(C=C2)O.[Br-]

InChI

InChI=1S/C12H17NO.C3H7NO2.BrH/c1-13(9-3-2-4-10-13)11-5-7-12(14)8-6-11;1-4(2)3(5)6;/h5-8H,2-4,9-10H2,1H3;1-2H3,(H,5,6);1H/p-1