N-phenethylcarbamate; triethyl(2-hydroxyethyl)azanium; hydrobromide

Systemtic Name: N-phenethylcarbamate; triethyl(2-hydroxyethyl)azanium; hydrobromide Openeye Name: N-phenethylcarbamate; triethyl(2-hydroxyethyl)ammonium; hydrobromide CAS Name: N-phenethylcarbamate; triethyl(2-hydroxyethyl)ammonium; hydrobromide IUPAC Name: N-phenethylcarbamate; triethyl(2-hydroxyethyl)azanium; hydrobromide Traditional Name: N-phenethylcarbamate; triethyl(2-hydroxyethyl)ammonium; hydrobromide Formula: C17H31BrN2O3 MolecularWeight: 391.34364

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](CC)(CC)CCO.C1=CC=C(C=C1)CCNC(=O)[O-].Br

Isomeric SMILES

CC[N+](CC)(CC)CCO.C1=CC=C(C=C1)CCNC(=O)[O-].Br

InChI

InChI=1S/C9H11NO2.C8H20NO.BrH/c11-9(12)10-7-6-8-4-2-1-3-5-8;1-4-9(5-2,6-3)7-8-10;/h1-5,10H,6-7H2,(H,11,12);10H,4-8H2,1-3H3;1H/q;+1;/p-1