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

Systemtic Name: [(4S)-4-(4-ethylphenyl)-4-(4-methylpiperazin-4-ium-1-yl)butyl]azanium Openeye Name: [(4S)-4-(4-ethylphenyl)-4-(4-methylpiperazin-4-ium-1-yl)butyl]ammonium CAS Name: [(4S)-4-(4-ethylphenyl)-4-(4-methyl-1-piperazin-4-iumyl)butyl]ammonium IUPAC Name: [(4S)-4-(4-ethylphenyl)-4-(4-methylpiperazin-4-ium-1-yl)butyl]azanium Traditional Name: [(4S)-4-(4-ethylphenyl)-4-(4-methylpiperazin-4-ium-1-yl)butyl]ammonium Formula: C17H31N3+2 MolecularWeight: 277.44814

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H29N3/c1-3-15-6-8-16(9-7-15)17(5-4-10-18)20-13-11-19(2)12-14-20/h6-9,17H,3-5,10-14,18H2,1-2H3/p+2/t17-/m0/s1