methyl 2-[(5-chloranyl-2-methoxy-phenyl)methylamino]-3-phenyl-4-azabicyclo[3.2.1]octane-6-carboxylate

Systemtic Name: methyl 2-[(5-chloranyl-2-methoxy-phenyl)methylamino]-3-phenyl-4-azabicyclo[3.2.1]octane-6-carboxylate Openeye Name: methyl 2-[(5-chloro-2-methoxy-phenyl)methylamino]-3-phenyl-4-azabicyclo[3.2.1]octane-6-carboxylate CAS Name: 2-[(5-chloro-2-methoxyphenyl)methylamino]-3-phenyl-4-azabicyclo[3.2.1]octane-6-carboxylic acid methyl ester IUPAC Name: methyl 2-[(5-chloro-2-methoxyphenyl)methylamino]-3-phenyl-4-azabicyclo[3.2.1]octane-6-carboxylate Traditional Name: 2-[(5-chloro-2-methoxy-benzyl)amino]-3-phenyl-4-azabicyclo[3.2.1]octane-6-carboxylic acid methyl ester Formula: C23H27ClN2O3 MolecularWeight: 414.92508

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)CNC2C3CC(C(C3)NC2C4=CC=CC=C4)C(=O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)CNC2C3CC(C(C3)NC2C4=CC=CC=C4)C(=O)OC

InChI

InChI=1S/C23H27ClN2O3/c1-28-20-9-8-17(24)10-16(20)13-25-21-15-11-18(23(27)29-2)19(12-15)26-22(21)14-6-4-3-5-7-14/h3-10,15,18-19,21-22,25-26H,11-13H2,1-2H3