1-[(2S)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]piperazin-4-ium

Systemtic Name: 1-[(2S)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]piperazin-4-ium Openeye Name: 1-[(2S)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]piperazin-4-ium CAS Name: 1-[(2S)-2-phenyl-2-(1-pyrrolidin-1-iumyl)ethyl]piperazin-4-ium IUPAC Name: 1-[(2S)-2-phenyl-2-pyrrolidin-1-ium-1-ylethyl]piperazin-4-ium Traditional Name: 1-[(2S)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]piperazin-4-ium Formula: C16H27N3+2 MolecularWeight: 261.40568

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)C(CN2CC[NH2+]CC2)C3=CC=CC=C3

Isomeric SMILES

C1CC[NH+](C1)[C@H](CN2CC[NH2+]CC2)C3=CC=CC=C3

InChI

InChI=1S/C16H25N3/c1-2-6-15(7-3-1)16(19-10-4-5-11-19)14-18-12-8-17-9-13-18/h1-3,6-7,16-17H,4-5,8-14H2/p+2/t16-/m1/s1