N,N-dimethylcarbamate; dimethyl-[(2-oxidanylnaphthalen-1-yl)methyl]-(phenylmethyl)azanium; bromide

Systemtic Name: N,N-dimethylcarbamate; dimethyl-[(2-oxidanylnaphthalen-1-yl)methyl]-(phenylmethyl)azanium; bromide Openeye Name: benzyl-[(2-hydroxy-1-naphthyl)methyl]-dimethyl-ammonium; N,N-dimethylcarbamate; bromide CAS Name: N,N-dimethylcarbamate; (2-hydroxy-1-naphthalenyl)methyl-dimethyl-(phenylmethyl)ammonium; bromide IUPAC Name: benzyl-[(2-hydroxynaphthalen-1-yl)methyl]-dimethylazanium; N,N-dimethylcarbamate; bromide Traditional Name: benzyl-[(2-hydroxy-1-naphthyl)methyl]-dimethyl-ammonium; N,N-dimethylcarbamate; bromide Formula: C23H28BrN2O3- MolecularWeight: 460.38402

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)[O-].C[N+](C)(CC1=CC=CC=C1)CC2=C(C=CC3=CC=CC=C32)O.[Br-]

Isomeric SMILES

CN(C)C(=O)[O-].C[N+](C)(CC1=CC=CC=C1)CC2=C(C=CC3=CC=CC=C32)O.[Br-]

InChI

InChI=1S/C20H21NO.C3H7NO2.BrH/c1-21(2,14-16-8-4-3-5-9-16)15-19-18-11-7-6-10-17(18)12-13-20(19)22;1-4(2)3(5)6;/h3-13H,14-15H2,1-2H3;1-2H3,(H,5,6);1H/p-1