butyl-[[4-[(2R)-3-(4-ethylpiperazin-4-ium-1-yl)-2-oxidanyl-propoxy]-3-methoxy-phenyl]methyl]-methyl-azanium

Systemtic Name: butyl-[[4-[(2R)-3-(4-ethylpiperazin-4-ium-1-yl)-2-oxidanyl-propoxy]-3-methoxy-phenyl]methyl]-methyl-azanium Openeye Name: butyl-[[4-[(2R)-3-(4-ethylpiperazin-4-ium-1-yl)-2-hydroxy-propoxy]-3-methoxy-phenyl]methyl]-methyl-ammonium CAS Name: butyl-[[4-[(2R)-3-(4-ethyl-1-piperazin-4-iumyl)-2-hydroxypropoxy]-3-methoxyphenyl]methyl]-methylammonium IUPAC Name: butyl-[[4-[(2R)-3-(4-ethylpiperazin-4-ium-1-yl)-2-hydroxypropoxy]-3-methoxyphenyl]methyl]-methylazanium Traditional Name: butyl-[4-[(2R)-3-(4-ethylpiperazin-4-ium-1-yl)-2-hydroxy-propoxy]-3-methoxy-benzyl]-methyl-ammonium Formula: C22H41N3O3+2 MolecularWeight: 395.57924

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](C)CC1=CC(=C(C=C1)OCC(CN2CC[NH+](CC2)CC)O)OC

Isomeric SMILES

CCCC[NH+](C)CC1=CC(=C(C=C1)OC[C@@H](CN2CC[NH+](CC2)CC)O)OC

InChI

InChI=1S/C22H39N3O3/c1-5-7-10-23(3)16-19-8-9-21(22(15-19)27-4)28-18-20(26)17-25-13-11-24(6-2)12-14-25/h8-9,15,20,26H,5-7,10-14,16-18H2,1-4H3/p+2/t20-/m1/s1