methyl 3-(4-chloranyl-3-methoxy-phenyl)-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylate

Systemtic Name: methyl 3-(4-chloranyl-3-methoxy-phenyl)-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylate Openeye Name: methyl 3-(4-chloro-3-methoxy-phenyl)-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylate CAS Name: 3-(4-chloro-3-methoxyphenyl)-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylic acid methyl ester IUPAC Name: methyl 3-(4-chloro-3-methoxyphenyl)-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylate Traditional Name: 3-(4-chloro-3-methoxy-phenyl)-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylic acid methyl ester Formula: C17H22ClNO3 MolecularWeight: 323.81448

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2CCC1C(C(C2)C3=CC(=C(C=C3)Cl)OC)C(=O)OC

Isomeric SMILES

CN1C2CCC1C(C(C2)C3=CC(=C(C=C3)Cl)OC)C(=O)OC

InChI

InChI=1S/C17H22ClNO3/c1-19-11-5-7-14(19)16(17(20)22-3)12(9-11)10-4-6-13(18)15(8-10)21-2/h4,6,8,11-12,14,16H,5,7,9H2,1-3H3