N-methylcarbamate; 1-prop-2-enylquinolin-1-ium-8-ol; hydrobromide

Systemtic Name: N-methylcarbamate; 1-prop-2-enylquinolin-1-ium-8-ol; hydrobromide Openeye Name: 1-allylquinolin-1-ium-8-ol; N-methylcarbamate; hydrobromide CAS Name: N-methylcarbamate; 1-prop-2-enyl-8-quinolin-1-iumol; hydrobromide IUPAC Name: N-methylcarbamate; 1-prop-2-enylquinolin-1-ium-8-ol; hydrobromide Traditional Name: 1-allylquinolin-1-ium-8-ol; N-methylcarbamate; hydrobromide Formula: C14H17BrN2O3 MolecularWeight: 341.20038

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)[O-].C=CC[N+]1=CC=CC2=C1C(=CC=C2)O.Br

Isomeric SMILES

CNC(=O)[O-].C=CC[N+]1=CC=CC2=C1C(=CC=C2)O.Br

InChI

InChI=1S/C12H11NO.C2H5NO2.BrH/c1-2-8-13-9-4-6-10-5-3-7-11(14)12(10)13;1-3-2(4)5;/h2-7,9H,1,8H2;3H,1H3,(H,4,5);1H