[(2R)-2-(4-hexoxyphenyl)-2-(4-methylpiperazin-4-ium-1-yl)ethyl]azanium

Systemtic Name: [(2R)-2-(4-hexoxyphenyl)-2-(4-methylpiperazin-4-ium-1-yl)ethyl]azanium Openeye Name: [(2R)-2-(4-hexoxyphenyl)-2-(4-methylpiperazin-4-ium-1-yl)ethyl]ammonium CAS Name: [(2R)-2-(4-hexoxyphenyl)-2-(4-methyl-1-piperazin-4-iumyl)ethyl]ammonium IUPAC Name: [(2R)-2-(4-hexoxyphenyl)-2-(4-methylpiperazin-4-ium-1-yl)ethyl]azanium Traditional Name: [(2R)-2-(4-hexoxyphenyl)-2-(4-methylpiperazin-4-ium-1-yl)ethyl]ammonium Formula: C19H35N3O+2 MolecularWeight: 321.5007

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C(C[NH3+])N2CC[NH+](CC2)C

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)[C@H](C[NH3+])N2CC[NH+](CC2)C

InChI

InChI=1S/C19H33N3O/c1-3-4-5-6-15-23-18-9-7-17(8-10-18)19(16-20)22-13-11-21(2)12-14-22/h7-10,19H,3-6,11-16,20H2,1-2H3/p+2/t19-/m0/s1