2-cyclopentyl-2-phenyl-ethanoate; (1R,5S)-8-methyl-8-propan-2-yl-8-azoniabicyclo[3.2.1]octan-3-ol; hydrobromide

Systemtic Name: 2-cyclopentyl-2-phenyl-ethanoate; (1R,5S)-8-methyl-8-propan-2-yl-8-azoniabicyclo[3.2.1]octan-3-ol; hydrobromide Openeye Name: 2-cyclopentyl-2-phenyl-acetate; (1R,5S)-8-isopropyl-8-methyl-8-azoniabicyclo[3.2.1]octan-3-ol; hydrobromide CAS Name: 2-cyclopentyl-2-phenylacetate; (1R,5S)-8-methyl-8-propan-2-yl-8-azoniabicyclo[3.2.1]octan-3-ol; hydrobromide IUPAC Name: 2-cyclopentyl-2-phenylacetate; (1R,5S)-8-methyl-8-propan-2-yl-8-azoniabicyclo[3.2.1]octan-3-ol; hydrobromide Traditional Name: 2-cyclopentyl-2-phenyl-acetate; (1R,5S)-8-isopropyl-8-methyl-8-azoniabicyclo[3.2.1]octan-3-ol; hydrobromide Formula: C24H38BrNO3 MolecularWeight: 468.46742

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[N+]1(C2CCC1CC(C2)O)C.C1CCC(C1)C(C2=CC=CC=C2)C(=O)[O-].Br

Isomeric SMILES

CC(C)[N+]1([C@@H]2CC[C@H]1CC(C2)O)C.C1CCC(C1)C(C2=CC=CC=C2)C(=O)[O-].Br

InChI

InChI=1S/C13H16O2.C11H22NO.BrH/c14-13(15)12(11-8-4-5-9-11)10-6-2-1-3-7-10;1-8(2)12(3)9-4-5-10(12)7-11(13)6-9;/h1-3,6-7,11-12H,4-5,8-9H2,(H,14,15);8-11,13H,4-7H2,1-3H3;1H/q;+1;/p-1/t;9-,10+,11?,12?;