(3-acetamido-5-pyrrolidin-1-ylcarbonyl-phenyl)methyl-[(2R)-1-(2-fluorophenyl)propan-2-yl]azanium

Systemtic Name: (3-acetamido-5-pyrrolidin-1-ylcarbonyl-phenyl)methyl-[(2R)-1-(2-fluorophenyl)propan-2-yl]azanium Openeye Name: [3-acetamido-5-(pyrrolidine-1-carbonyl)phenyl]methyl-[(1R)-2-(2-fluorophenyl)-1-methyl-ethyl]ammonium CAS Name: [3-acetamido-5-[oxo(1-pyrrolidinyl)methyl]phenyl]methyl-[(2R)-1-(2-fluorophenyl)propan-2-yl]ammonium IUPAC Name: [3-acetamido-5-(pyrrolidine-1-carbonyl)phenyl]methyl-[(2R)-1-(2-fluorophenyl)propan-2-yl]azanium Traditional Name: [3-acetamido-5-(pyrrolidine-1-carbonyl)benzyl]-[(1R)-2-(2-fluorophenyl)-1-methyl-ethyl]ammonium Formula: C23H29FN3O2+ MolecularWeight: 398.493663

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=CC=C1F)[NH2+]CC2=CC(=CC(=C2)C(=O)N3CCCC3)NC(=O)C

Isomeric SMILES

C[C@H](CC1=CC=CC=C1F)[NH2+]CC2=CC(=CC(=C2)C(=O)N3CCCC3)NC(=O)C

InChI

InChI=1S/C23H28FN3O2/c1-16(11-19-7-3-4-8-22(19)24)25-15-18-12-20(14-21(13-18)26-17(2)28)23(29)27-9-5-6-10-27/h3-4,7-8,12-14,16,25H,5-6,9-11,15H2,1-2H3,(H,26,28)/p+1/t16-/m1/s1