1-ethyl-4-[(3S)-3-phenylbutyl]piperazine-1,4-diium

Systemtic Name: 1-ethyl-4-[(3S)-3-phenylbutyl]piperazine-1,4-diium Openeye Name: 1-ethyl-4-[(3S)-3-phenylbutyl]piperazine-1,4-diium CAS Name: 1-ethyl-4-[(3S)-3-phenylbutyl]piperazine-1,4-diium IUPAC Name: 1-ethyl-4-[(3S)-3-phenylbutyl]piperazine-1,4-diium Traditional Name: 1-ethyl-4-[(3S)-3-phenylbutyl]piperazine-1,4-diium Formula: C16H28N2+2 MolecularWeight: 248.40692

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CC[NH+](CC1)CCC(C)C2=CC=CC=C2

Isomeric SMILES

CC[NH+]1CC[NH+](CC1)CC[C@H](C)C2=CC=CC=C2

InChI

InChI=1S/C16H26N2/c1-3-17-11-13-18(14-12-17)10-9-15(2)16-7-5-4-6-8-16/h4-8,15H,3,9-14H2,1-2H3/p+2/t15-/m0/s1