N-[(2R)-2-(4-dimethylaminophenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-3,4-bis(fluoranyl)benzamide

Systemtic Name: N-[(2R)-2-(4-dimethylaminophenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-3,4-bis(fluoranyl)benzamide Openeye Name: N-[(2R)-2-(4-dimethylaminophenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-3,4-difluoro-benzamide CAS Name: N-[(2R)-2-(4-dimethylaminophenyl)-2-(1-pyrrolidin-1-iumyl)ethyl]-3,4-difluorobenzamide IUPAC Name: N-[(2R)-2-(4-dimethylaminophenyl)-2-pyrrolidin-1-ium-1-ylethyl]-3,4-difluorobenzamide Traditional Name: N-[(2R)-2-(4-dimethylaminophenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-3,4-difluoro-benzamide Formula: C21H26F2N3O+ MolecularWeight: 374.447446

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C(CNC(=O)C2=CC(=C(C=C2)F)F)[NH+]3CCCC3

Isomeric SMILES

CN(C)C1=CC=C(C=C1)[C@H](CNC(=O)C2=CC(=C(C=C2)F)F)[NH+]3CCCC3

InChI

InChI=1S/C21H25F2N3O/c1-25(2)17-8-5-15(6-9-17)20(26-11-3-4-12-26)14-24-21(27)16-7-10-18(22)19(23)13-16/h5-10,13,20H,3-4,11-12,14H2,1-2H3,(H,24,27)/p+1/t20-/m0/s1