1-[(2S)-2-(diethylamino)-2-phenyl-ethyl]-3,4-dihydro-2H-pyrrol-1-ium-5-amine

Systemtic Name: 1-[(2S)-2-(diethylamino)-2-phenyl-ethyl]-3,4-dihydro-2H-pyrrol-1-ium-5-amine Openeye Name: 1-[(2S)-2-(diethylamino)-2-phenyl-ethyl]-3,4-dihydro-2H-pyrrol-1-ium-5-amine CAS Name: 1-[(2S)-2-(diethylamino)-2-phenylethyl]-3,4-dihydro-2H-pyrrol-1-ium-5-amine IUPAC Name: 1-[(2S)-2-(diethylamino)-2-phenylethyl]-3,4-dihydro-2H-pyrrol-1-ium-5-amine Traditional Name: [(1S)-2-(2-amino-1-pyrrolin-1-ium-1-yl)-1-phenyl-ethyl]-diethyl-amine Formula: C16H26N3+ MolecularWeight: 260.39774

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCN(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+1/t15-/m1/s1