[(1S)-1-phenyl-3-(4-propylpiperazin-4-ium-1-yl)propyl]azanium

Systemtic Name: [(1S)-1-phenyl-3-(4-propylpiperazin-4-ium-1-yl)propyl]azanium Openeye Name: [(1S)-1-phenyl-3-(4-propylpiperazin-4-ium-1-yl)propyl]ammonium CAS Name: [(1S)-1-phenyl-3-(4-propyl-1-piperazin-4-iumyl)propyl]ammonium IUPAC Name: [(1S)-1-phenyl-3-(4-propylpiperazin-4-ium-1-yl)propyl]azanium Traditional Name: [(1S)-1-phenyl-3-(4-propylpiperazin-4-ium-1-yl)propyl]ammonium Formula: C16H29N3+2 MolecularWeight: 263.42156

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCN(CC1)CCC(C2=CC=CC=C2)[NH3+]

Isomeric SMILES

CCC[NH+]1CCN(CC1)CC[C@@H](C2=CC=CC=C2)[NH3+]

InChI

InChI=1S/C16H27N3/c1-2-9-18-11-13-19(14-12-18)10-8-16(17)15-6-4-3-5-7-15/h3-7,16H,2,8-14,17H2,1H3/p+2/t16-/m0/s1