[(2R)-2-(4-ethylpiperazin-4-ium-1-yl)-2-(3-pentoxyphenyl)ethyl]azanium

Systemtic Name: [(2R)-2-(4-ethylpiperazin-4-ium-1-yl)-2-(3-pentoxyphenyl)ethyl]azanium Openeye Name: [(2R)-2-(4-ethylpiperazin-4-ium-1-yl)-2-(3-pentoxyphenyl)ethyl]ammonium CAS Name: [(2R)-2-(4-ethyl-1-piperazin-4-iumyl)-2-(3-pentoxyphenyl)ethyl]ammonium IUPAC Name: [(2R)-2-(4-ethylpiperazin-4-ium-1-yl)-2-(3-pentoxyphenyl)ethyl]azanium Traditional Name: [(2R)-2-(3-amoxyphenyl)-2-(4-ethylpiperazin-4-ium-1-yl)ethyl]ammonium Formula: C19H35N3O+2 MolecularWeight: 321.5007

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=CC(=C1)C(C[NH3+])N2CC[NH+](CC2)CC

Isomeric SMILES

CCCCCOC1=CC=CC(=C1)[C@H](C[NH3+])N2CC[NH+](CC2)CC

InChI

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