[(1S)-2-(5-azanyl-3,4-dihydro-2H-pyrrol-1-ium-1-yl)-1-phenyl-ethyl]-diethyl-azanium

Systemtic Name: [(1S)-2-(5-azanyl-3,4-dihydro-2H-pyrrol-1-ium-1-yl)-1-phenyl-ethyl]-diethyl-azanium Openeye Name: [(1S)-2-(5-amino-3,4-dihydro-2H-pyrrol-1-ium-1-yl)-1-phenyl-ethyl]-diethyl-ammonium CAS Name: [(1S)-2-(5-amino-3,4-dihydro-2H-pyrrol-1-ium-1-yl)-1-phenylethyl]-diethylammonium IUPAC Name: [(1S)-2-(5-amino-3,4-dihydro-2H-pyrrol-1-ium-1-yl)-1-phenylethyl]-diethylazanium Traditional Name: [(1S)-2-(2-amino-1-pyrrolin-1-ium-1-yl)-1-phenyl-ethyl]-diethyl-ammonium Formula: C16H27N3+2 MolecularWeight: 261.40568

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)C(C[N+]1=C(CCC1)N)C2=CC=CC=C2

Isomeric SMILES

CC[NH+](CC)[C@H](C[N+]1=C(CCC1)N)C2=CC=CC=C2

InChI

InChI=1S/C16H25N3/c1-3-18(4-2)15(14-9-6-5-7-10-14)13-19-12-8-11-16(19)17/h5-7,9-10,15,17H,3-4,8,11-13H2,1-2H3/p+2/t15-/m1/s1