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

Systemtic Name: cyclohexyl-[[4-[(2R)-3-(4-ethylpiperazin-4-ium-1-yl)-2-oxidanyl-propoxy]-3-methoxy-phenyl]methyl]-methyl-azanium Openeye Name: cyclohexyl-[[4-[(2R)-3-(4-ethylpiperazin-4-ium-1-yl)-2-hydroxy-propoxy]-3-methoxy-phenyl]methyl]-methyl-ammonium CAS Name: cyclohexyl-[[4-[(2R)-3-(4-ethyl-1-piperazin-4-iumyl)-2-hydroxypropoxy]-3-methoxyphenyl]methyl]-methylammonium IUPAC Name: cyclohexyl-[[4-[(2R)-3-(4-ethylpiperazin-4-ium-1-yl)-2-hydroxypropoxy]-3-methoxyphenyl]methyl]-methylazanium Traditional Name: cyclohexyl-[4-[(2R)-3-(4-ethylpiperazin-4-ium-1-yl)-2-hydroxy-propoxy]-3-methoxy-benzyl]-methyl-ammonium Formula: C24H43N3O3+2 MolecularWeight: 421.61652

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)CC(COC2=C(C=C(C=C2)C[NH+](C)C3CCCCC3)OC)O

Isomeric SMILES

CC[NH+]1CCN(CC1)C[C@H](COC2=C(C=C(C=C2)C[NH+](C)C3CCCCC3)OC)O

InChI

InChI=1S/C24H41N3O3/c1-4-26-12-14-27(15-13-26)18-22(28)19-30-23-11-10-20(16-24(23)29-3)17-25(2)21-8-6-5-7-9-21/h10-11,16,21-22,28H,4-9,12-15,17-19H2,1-3H3/p+2/t22-/m1/s1