N,N-dimethylcarbamate; 2-[(1-methylpiperidin-1-ium-1-yl)methyl]naphthalen-1-ol; bromide

Systemtic Name: N,N-dimethylcarbamate; 2-[(1-methylpiperidin-1-ium-1-yl)methyl]naphthalen-1-ol; bromide Openeye Name: N,N-dimethylcarbamate; 2-[(1-methylpiperidin-1-ium-1-yl)methyl]naphthalen-1-ol; bromide CAS Name: N,N-dimethylcarbamate; 2-[(1-methyl-1-piperidin-1-iumyl)methyl]-1-naphthalenol; bromide IUPAC Name: N,N-dimethylcarbamate; 2-[(1-methylpiperidin-1-ium-1-yl)methyl]naphthalen-1-ol; bromide Traditional Name: N,N-dimethylcarbamate; 2-[(1-methylpiperidin-1-ium-1-yl)methyl]-1-naphthol; bromide Formula: C20H28BrN2O3- MolecularWeight: 424.35192

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)[O-].C[N+]1(CCCCC1)CC2=C(C3=CC=CC=C3C=C2)O.[Br-]

Isomeric SMILES

CN(C)C(=O)[O-].C[N+]1(CCCCC1)CC2=C(C3=CC=CC=C3C=C2)O.[Br-]

InChI

InChI=1S/C17H21NO.C3H7NO2.BrH/c1-18(11-5-2-6-12-18)13-15-10-9-14-7-3-4-8-16(14)17(15)19;1-4(2)3(5)6;/h3-4,7-10H,2,5-6,11-13H2,1H3;1-2H3,(H,5,6);1H/p-1