diethyl-[(1S)-1-phenyl-2-[[(2R)-pyrrolidin-1-ium-2-yl]carbonylamino]ethyl]azanium

Systemtic Name: diethyl-[(1S)-1-phenyl-2-[[(2R)-pyrrolidin-1-ium-2-yl]carbonylamino]ethyl]azanium Openeye Name: diethyl-[(1S)-1-phenyl-2-[[(2R)-pyrrolidin-1-ium-2-carbonyl]amino]ethyl]ammonium CAS Name: diethyl-[(1S)-2-[[oxo-[(2R)-2-pyrrolidin-1-iumyl]methyl]amino]-1-phenylethyl]ammonium IUPAC Name: diethyl-[(1S)-1-phenyl-2-[[(2R)-pyrrolidin-1-ium-2-carbonyl]amino]ethyl]azanium Traditional Name: diethyl-[(1S)-1-phenyl-2-[[(2R)-pyrrolidin-1-ium-2-carbonyl]amino]ethyl]ammonium Formula: C17H29N3O+2 MolecularWeight: 291.43166

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)C(CNC(=O)C1CCC[NH2+]1)C2=CC=CC=C2

Isomeric SMILES

CC[NH+](CC)[C@H](CNC(=O)[C@H]1CCC[NH2+]1)C2=CC=CC=C2

InChI

InChI=1S/C17H27N3O/c1-3-20(4-2)16(14-9-6-5-7-10-14)13-19-17(21)15-11-8-12-18-15/h5-7,9-10,15-16,18H,3-4,8,11-13H2,1-2H3,(H,19,21)/p+2/t15-,16-/m1/s1