cyclohexyl-[(2R)-3-[2-[(3-ethoxypropylazaniumyl)methyl]phenoxy]-2-oxidanyl-propyl]-methyl-azanium

Systemtic Name: cyclohexyl-[(2R)-3-[2-[(3-ethoxypropylazaniumyl)methyl]phenoxy]-2-oxidanyl-propyl]-methyl-azanium Openeye Name: cyclohexyl-[(2R)-3-[2-[(3-ethoxypropylammonio)methyl]phenoxy]-2-hydroxy-propyl]-methyl-ammonium CAS Name: cyclohexyl-[(2R)-3-[2-[(3-ethoxypropylammonio)methyl]phenoxy]-2-hydroxypropyl]-methylammonium IUPAC Name: cyclohexyl-[(2R)-3-[2-[(3-ethoxypropylazaniumyl)methyl]phenoxy]-2-hydroxypropyl]-methylazanium Traditional Name: cyclohexyl-[(2R)-3-[2-[(3-ethoxypropylammonio)methyl]phenoxy]-2-hydroxy-propyl]-methyl-ammonium Formula: C22H40N2O3+2 MolecularWeight: 380.5646

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCC[NH2+]CC1=CC=CC=C1OCC(C[NH+](C)C2CCCCC2)O

Isomeric SMILES

CCOCCC[NH2+]CC1=CC=CC=C1OC[C@@H](C[NH+](C)C2CCCCC2)O

InChI

InChI=1S/C22H38N2O3/c1-3-26-15-9-14-23-16-19-10-7-8-13-22(19)27-18-21(25)17-24(2)20-11-5-4-6-12-20/h7-8,10,13,20-21,23,25H,3-6,9,11-12,14-18H2,1-2H3/p+2/t21-/m1/s1