1,4-diazabicyclo[2.2.2]octan-3-ylmethyl 5-chloranyl-2-methoxy-benzoate

Systemtic Name: 1,4-diazabicyclo[2.2.2]octan-3-ylmethyl 5-chloranyl-2-methoxy-benzoate Openeye Name: 1,4-diazabicyclo[2.2.2]octan-3-ylmethyl 5-chloro-2-methoxy-benzoate CAS Name: 5-chloro-2-methoxybenzoic acid 1,4-diazabicyclo[2.2.2]octan-3-ylmethyl ester IUPAC Name: 1,4-diazabicyclo[2.2.2]octan-3-ylmethyl 5-chloro-2-methoxybenzoate Traditional Name: 5-chloro-2-methoxy-benzoic acid 1,4-diazabicyclo[2.2.2]octan-3-ylmethyl ester Formula: C15H19ClN2O3 MolecularWeight: 310.77596

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)C(=O)OCC2CN3CCN2CC3

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)C(=O)OCC2CN3CCN2CC3

InChI

InChI=1S/C15H19ClN2O3/c1-20-14-3-2-11(16)8-13(14)15(19)21-10-12-9-17-4-6-18(12)7-5-17/h2-3,8,12H,4-7,9-10H2,1H3