(4-aminocarbonyl-2-fluoranyl-phenyl)methyl-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]azanium

Systemtic Name: (4-aminocarbonyl-2-fluoranyl-phenyl)methyl-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]azanium Openeye Name: (4-carbamoyl-2-fluoro-phenyl)methyl-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]ammonium CAS Name: (4-carbamoyl-2-fluorophenyl)methyl-[[(2S)-1-ethyl-2-pyrrolidinyl]methyl]ammonium IUPAC Name: (4-carbamoyl-2-fluorophenyl)methyl-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]azanium Traditional Name: (4-carbamoyl-2-fluoro-benzyl)-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]ammonium Formula: C15H23FN3O+ MolecularWeight: 280.361023

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCCC1C[NH2+]CC2=C(C=C(C=C2)C(=O)N)F

Isomeric SMILES

CCN1CCC[C@H]1C[NH2+]CC2=C(C=C(C=C2)C(=O)N)F

InChI

InChI=1S/C15H22FN3O/c1-2-19-7-3-4-13(19)10-18-9-12-6-5-11(15(17)20)8-14(12)16/h5-6,8,13,18H,2-4,7,9-10H2,1H3,(H2,17,20)/p+1/t13-/m0/s1