2-(3,4-dimethoxyphenyl)ethyl 3,7-diazabicyclo[3.3.1]nonane-3-carboxylate

Systemtic Name: 2-(3,4-dimethoxyphenyl)ethyl 3,7-diazabicyclo[3.3.1]nonane-3-carboxylate Openeye Name: 2-(3,4-dimethoxyphenyl)ethyl 3,7-diazabicyclo[3.3.1]nonane-3-carboxylate CAS Name: 3,7-diazabicyclo[3.3.1]nonane-3-carboxylic acid 2-(3,4-dimethoxyphenyl)ethyl ester IUPAC Name: 2-(3,4-dimethoxyphenyl)ethyl 3,7-diazabicyclo[3.3.1]nonane-3-carboxylate Traditional Name: 3,7-diazabicyclo[3.3.1]nonane-3-carboxylic acid homoveratryl ester Formula: C18H26N2O4 MolecularWeight: 334.41004

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCOC(=O)N2CC3CC(C2)CNC3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCOC(=O)N2CC3CC(C2)CNC3)OC

InChI

InChI=1S/C18H26N2O4/c1-22-16-4-3-13(8-17(16)23-2)5-6-24-18(21)20-11-14-7-15(12-20)10-19-9-14/h3-4,8,14-15,19H,5-7,9-12H2,1-2H3