(8-methyl-8-azoniabicyclo[3.2.1]octan-3-yl) 4-chloranylbenzoate chloride

Systemtic Name: (8-methyl-8-azoniabicyclo[3.2.1]octan-3-yl) 4-chloranylbenzoate chloride Openeye Name: (8-methyl-8-azoniabicyclo[3.2.1]octan-3-yl) 4-chlorobenzoate chloride CAS Name: 4-chlorobenzoic acid (8-methyl-8-azoniabicyclo[3.2.1]octan-3-yl) ester chloride IUPAC Name: (8-methyl-8-azoniabicyclo[3.2.1]octan-3-yl) 4-chlorobenzoate chloride Traditional Name: 4-chlorobenzoic acid (8-methyl-8-azoniabicyclo[3.2.1]octan-3-yl) ester chloride Formula: C15H19Cl2NO2 MolecularWeight: 316.22286

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1C2CCC1CC(C2)OC(=O)C3=CC=C(C=C3)Cl.[Cl-]

Isomeric SMILES

C[NH+]1C2CCC1CC(C2)OC(=O)C3=CC=C(C=C3)Cl.[Cl-]

InChI

InChI=1S/C15H18ClNO2.ClH/c1-17-12-6-7-13(17)9-14(8-12)19-15(18)10-2-4-11(16)5-3-10;/h2-5,12-14H,6-9H2,1H3;1H