(3-fluoranyl-4-methoxy-phenyl)methyl-methyl-[2-oxidanylidene-2-[(4-piperidin-1-ylphenyl)amino]ethyl]azanium

Systemtic Name: (3-fluoranyl-4-methoxy-phenyl)methyl-methyl-[2-oxidanylidene-2-[(4-piperidin-1-ylphenyl)amino]ethyl]azanium Openeye Name: (3-fluoro-4-methoxy-phenyl)methyl-methyl-[2-oxo-2-[4-(1-piperidyl)anilino]ethyl]ammonium CAS Name: (3-fluoro-4-methoxyphenyl)methyl-methyl-[2-oxo-2-[4-(1-piperidinyl)anilino]ethyl]ammonium IUPAC Name: (3-fluoro-4-methoxyphenyl)methyl-methyl-[2-oxo-2-(4-piperidin-1-ylanilino)ethyl]azanium Traditional Name: (3-fluoro-4-methoxy-benzyl)-[2-keto-2-(4-piperidinoanilino)ethyl]-methyl-ammonium Formula: C22H29FN3O2+ MolecularWeight: 386.482963

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC(=C(C=C1)OC)F)CC(=O)NC2=CC=C(C=C2)N3CCCCC3

Isomeric SMILES

C[NH+](CC1=CC(=C(C=C1)OC)F)CC(=O)NC2=CC=C(C=C2)N3CCCCC3

InChI

InChI=1S/C22H28FN3O2/c1-25(15-17-6-11-21(28-2)20(23)14-17)16-22(27)24-18-7-9-19(10-8-18)26-12-4-3-5-13-26/h6-11,14H,3-5,12-13,15-16H2,1-2H3,(H,24,27)/p+1