2-[(5-fluoranyl-2-methoxy-phenyl)methylamino]-3-phenyl-4-azabicyclo[3.3.1]nonane-6-carboxylic acid

Systemtic Name: 2-[(5-fluoranyl-2-methoxy-phenyl)methylamino]-3-phenyl-4-azabicyclo[3.3.1]nonane-6-carboxylic acid Openeye Name: 2-[(5-fluoro-2-methoxy-phenyl)methylamino]-3-phenyl-4-azabicyclo[3.3.1]nonane-6-carboxylic acid CAS Name: 2-[(5-fluoro-2-methoxyphenyl)methylamino]-3-phenyl-4-azabicyclo[3.3.1]nonane-6-carboxylic acid IUPAC Name: 2-[(5-fluoro-2-methoxyphenyl)methylamino]-3-phenyl-4-azabicyclo[3.3.1]nonane-6-carboxylic acid Traditional Name: 2-[(5-fluoro-2-methoxy-benzyl)amino]-3-phenyl-4-azabicyclo[3.3.1]nonane-6-carboxylic acid Formula: C23H27FN2O3 MolecularWeight: 398.470483

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)F)CNC2C3CCC(C(C3)NC2C4=CC=CC=C4)C(=O)O

Isomeric SMILES

COC1=C(C=C(C=C1)F)CNC2C3CCC(C(C3)NC2C4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C23H27FN2O3/c1-29-20-10-8-17(24)11-16(20)13-25-21-15-7-9-18(23(27)28)19(12-15)26-22(21)14-5-3-2-4-6-14/h2-6,8,10-11,15,18-19,21-22,25-26H,7,9,12-13H2,1H3,(H,27,28)