(8-methyl-8-propan-2-yl-8-azoniabicyclo[3.2.1]octan-3-yl) 2-propylpentanoate

Systemtic Name: (8-methyl-8-propan-2-yl-8-azoniabicyclo[3.2.1]octan-3-yl) 2-propylpentanoate Openeye Name: (8-isopropyl-8-methyl-8-azoniabicyclo[3.2.1]octan-3-yl) 2-propylpentanoate CAS Name: 2-propylpentanoic acid (8-methyl-8-propan-2-yl-8-azoniabicyclo[3.2.1]octan-3-yl) ester IUPAC Name: (8-methyl-8-propan-2-yl-8-azoniabicyclo[3.2.1]octan-3-yl) 2-propylpentanoate Traditional Name: 2-propylvaleric acid (8-isopropyl-8-methyl-8-azoniabicyclo[3.2.1]octan-3-yl) ester Formula: C19H36NO2+ MolecularWeight: 310.49464

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)C(=O)OC1CC2CCC(C1)[N+]2(C)C(C)C

Isomeric SMILES

CCCC(CCC)C(=O)OC1CC2CCC(C1)[N+]2(C)C(C)C

InChI

InChI=1S/C19H36NO2/c1-6-8-15(9-7-2)19(21)22-18-12-16-10-11-17(13-18)20(16,5)14(3)4/h14-18H,6-13H2,1-5H3/q+1