[5-(2,3-dimethoxyphenyl)-2-methyl-2-azabicyclo[3.3.1]nonan-4-yl] benzoate

Systemtic Name: [5-(2,3-dimethoxyphenyl)-2-methyl-2-azabicyclo[3.3.1]nonan-4-yl] benzoate Openeye Name: [5-(2,3-dimethoxyphenyl)-2-methyl-2-azabicyclo[3.3.1]nonan-4-yl] benzoate CAS Name: benzoic acid [5-(2,3-dimethoxyphenyl)-2-methyl-2-azabicyclo[3.3.1]nonan-4-yl] ester IUPAC Name: [5-(2,3-dimethoxyphenyl)-2-methyl-2-azabicyclo[3.3.1]nonan-4-yl] benzoate Traditional Name: benzoic acid [5-(2,3-dimethoxyphenyl)-2-methyl-2-azabicyclo[3.3.1]nonan-4-yl] ester Formula: C24H29NO4 MolecularWeight: 395.49136

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC(C2(CCCC1C2)C3=C(C(=CC=C3)OC)OC)OC(=O)C4=CC=CC=C4

Isomeric SMILES

CN1CC(C2(CCCC1C2)C3=C(C(=CC=C3)OC)OC)OC(=O)C4=CC=CC=C4

InChI

InChI=1S/C24H29NO4/c1-25-16-21(29-23(26)17-9-5-4-6-10-17)24(14-8-11-18(25)15-24)19-12-7-13-20(27-2)22(19)28-3/h4-7,9-10,12-13,18,21H,8,11,14-16H2,1-3H3