N-ethylcarbamate; 1-prop-2-enylquinolin-1-ium-8-ol; bromide

Systemtic Name: N-ethylcarbamate; 1-prop-2-enylquinolin-1-ium-8-ol; bromide Openeye Name: 1-allylquinolin-1-ium-8-ol; N-ethylcarbamate; bromide CAS Name: N-ethylcarbamate; 1-prop-2-enyl-8-quinolin-1-iumol; bromide IUPAC Name: N-ethylcarbamate; 1-prop-2-enylquinolin-1-ium-8-ol; bromide Traditional Name: 1-allylquinolin-1-ium-8-ol; N-ethylcarbamate; bromide Formula: C15H18BrN2O3- MolecularWeight: 354.21902

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H11NO.C3H7NO2.BrH/c1-2-8-13-9-4-6-10-5-3-7-11(14)12(10)13;1-2-4-3(5)6;/h2-7,9H,1,8H2;4H,2H2,1H3,(H,5,6);1H/p-1