1-phenylcyclopentane-1-carboxylate; triethyl(2-hydroxyethyl)azanium; bromide

Systemtic Name: 1-phenylcyclopentane-1-carboxylate; triethyl(2-hydroxyethyl)azanium; bromide Openeye Name: 1-phenylcyclopentanecarboxylate; triethyl(2-hydroxyethyl)ammonium; bromide CAS Name: 1-phenyl-1-cyclopentanecarboxylate; triethyl(2-hydroxyethyl)ammonium; bromide IUPAC Name: 1-phenylcyclopentane-1-carboxylate; triethyl(2-hydroxyethyl)azanium; bromide Traditional Name: 1-phenylcyclopentanecarboxylate; triethyl(2-hydroxyethyl)ammonium; bromide Formula: C20H33BrNO3- MolecularWeight: 415.38492

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](CC)(CC)CCO.C1CCC(C1)(C2=CC=CC=C2)C(=O)[O-].[Br-]

Isomeric SMILES

CC[N+](CC)(CC)CCO.C1CCC(C1)(C2=CC=CC=C2)C(=O)[O-].[Br-]

InChI

InChI=1S/C12H14O2.C8H20NO.BrH/c13-11(14)12(8-4-5-9-12)10-6-2-1-3-7-10;1-4-9(5-2,6-3)7-8-10;/h1-3,6-7H,4-5,8-9H2,(H,13,14);10H,4-8H2,1-3H3;1H/q;+1;/p-2