[(1R)-3-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methylamino]-3-oxidanylidene-1-phenyl-propyl]azanium

Systemtic Name: [(1R)-3-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methylamino]-3-oxidanylidene-1-phenyl-propyl]azanium Openeye Name: [(1R)-3-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methylamino]-3-oxo-1-phenyl-propyl]ammonium CAS Name: [(1R)-3-[[(2S)-1-ethyl-2-pyrrolidin-1-iumyl]methylamino]-3-oxo-1-phenylpropyl]ammonium IUPAC Name: [(1R)-3-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methylamino]-3-oxo-1-phenylpropyl]azanium Traditional Name: [(1R)-3-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methylamino]-3-keto-1-phenyl-propyl]ammonium Formula: C16H27N3O+2 MolecularWeight: 277.40508

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H25N3O/c1-2-19-10-6-9-14(19)12-18-16(20)11-15(17)13-7-4-3-5-8-13/h3-5,7-8,14-15H,2,6,9-12,17H2,1H3,(H,18,20)/p+2/t14-,15+/m0/s1