2-morpholin-4-ium-4-ylethyl 4,7,7-trimethylbicyclo[2.2.1]heptane-3-carboxylate chloride

Systemtic Name: 2-morpholin-4-ium-4-ylethyl 4,7,7-trimethylbicyclo[2.2.1]heptane-3-carboxylate chloride Openeye Name: 2-morpholin-4-ium-4-ylethyl 1,7,7-trimethylnorbornane-2-carboxylate chloride CAS Name: 4,7,7-trimethyl-3-bicyclo[2.2.1]heptanecarboxylic acid 2-(4-morpholin-4-iumyl)ethyl ester chloride IUPAC Name: 2-morpholin-4-ium-4-ylethyl 4,7,7-trimethylbicyclo[2.2.1]heptane-3-carboxylate chloride Traditional Name: 1,7,7-trimethylnorbornane-2-carboxylic acid 2-morpholin-4-ium-4-ylethyl ester chloride Formula: C17H30ClNO3 MolecularWeight: 331.878

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2CCC1(C(C2)C(=O)OCC[NH+]3CCOCC3)C)C.[Cl-]

Isomeric SMILES

CC1(C2CCC1(C(C2)C(=O)OCC[NH+]3CCOCC3)C)C.[Cl-]

InChI

InChI=1S/C17H29NO3.ClH/c1-16(2)13-4-5-17(16,3)14(12-13)15(19)21-11-8-18-6-9-20-10-7-18;/h13-14H,4-12H2,1-3H3;1H