cyclohexyl-[(2R)-3-[3-[(4-ethylpiperazin-4-ium-1-yl)methyl]phenoxy]-2-oxidanyl-propyl]-methyl-azanium

Systemtic Name: cyclohexyl-[(2R)-3-[3-[(4-ethylpiperazin-4-ium-1-yl)methyl]phenoxy]-2-oxidanyl-propyl]-methyl-azanium Openeye Name: cyclohexyl-[(2R)-3-[3-[(4-ethylpiperazin-4-ium-1-yl)methyl]phenoxy]-2-hydroxy-propyl]-methyl-ammonium CAS Name: cyclohexyl-[(2R)-3-[3-[(4-ethyl-1-piperazin-4-iumyl)methyl]phenoxy]-2-hydroxypropyl]-methylammonium IUPAC Name: cyclohexyl-[(2R)-3-[3-[(4-ethylpiperazin-4-ium-1-yl)methyl]phenoxy]-2-hydroxypropyl]-methylazanium Traditional Name: cyclohexyl-[(2R)-3-[3-[(4-ethylpiperazin-4-ium-1-yl)methyl]phenoxy]-2-hydroxy-propyl]-methyl-ammonium Formula: C23H41N3O2+2 MolecularWeight: 391.59054

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)CC2=CC(=CC=C2)OCC(C[NH+](C)C3CCCCC3)O

Isomeric SMILES

CC[NH+]1CCN(CC1)CC2=CC(=CC=C2)OC[C@@H](C[NH+](C)C3CCCCC3)O

InChI

InChI=1S/C23H39N3O2/c1-3-25-12-14-26(15-13-25)17-20-8-7-11-23(16-20)28-19-22(27)18-24(2)21-9-5-4-6-10-21/h7-8,11,16,21-22,27H,3-6,9-10,12-15,17-19H2,1-2H3/p+2/t22-/m1/s1