[3-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methylcarbamoyl]phenyl]methylazanium

Systemtic Name: [3-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methylcarbamoyl]phenyl]methylazanium Openeye Name: [3-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methylcarbamoyl]phenyl]methylammonium CAS Name: [3-[[[(2S)-1-ethyl-2-pyrrolidin-1-iumyl]methylamino]-oxomethyl]phenyl]methylammonium IUPAC Name: [3-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methylcarbamoyl]phenyl]methylazanium Traditional Name: [3-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methylcarbamoyl]benzyl]ammonium Formula: C15H25N3O+2 MolecularWeight: 263.3785

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCCC1CNC(=O)C2=CC(=CC=C2)C[NH3+]

Isomeric SMILES

CC[NH+]1CCC[C@H]1CNC(=O)C2=CC(=CC=C2)C[NH3+]

InChI

InChI=1S/C15H23N3O/c1-2-18-8-4-7-14(18)11-17-15(19)13-6-3-5-12(9-13)10-16/h3,5-6,9,14H,2,4,7-8,10-11,16H2,1H3,(H,17,19)/p+2/t14-/m0/s1