[(3S)-3-(4-ethylphenyl)-3-(4-methylpiperazin-4-ium-1-yl)propyl]azanium

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(CC[NH3+])N2CC[NH+](CC2)C

Isomeric SMILES

CCC1=CC=C(C=C1)[C@H](CC[NH3+])N2CC[NH+](CC2)C

InChI

InChI=1S/C16H27N3/c1-3-14-4-6-15(7-5-14)16(8-9-17)19-12-10-18(2)11-13-19/h4-7,16H,3,8-13,17H2,1-2H3/p+2/t16-/m0/s1