cyclohexyl-[(2R)-3-[2-methoxy-4-[[(1-oxidanylcyclohexyl)methylazaniumyl]methyl]phenoxy]-2-oxidanyl-propyl]-methyl-azanium

Systemtic Name: cyclohexyl-[(2R)-3-[2-methoxy-4-[[(1-oxidanylcyclohexyl)methylazaniumyl]methyl]phenoxy]-2-oxidanyl-propyl]-methyl-azanium Openeye Name: cyclohexyl-[(2R)-2-hydroxy-3-[4-[[(1-hydroxycyclohexyl)methylammonio]methyl]-2-methoxy-phenoxy]propyl]-methyl-ammonium CAS Name: cyclohexyl-[(2R)-2-hydroxy-3-[4-[[(1-hydroxycyclohexyl)methylammonio]methyl]-2-methoxyphenoxy]propyl]-methylammonium IUPAC Name: cyclohexyl-[(2R)-2-hydroxy-3-[4-[[(1-hydroxycyclohexyl)methylazaniumyl]methyl]-2-methoxyphenoxy]propyl]-methylazanium Traditional Name: cyclohexyl-[(2R)-2-hydroxy-3-[4-[[(1-hydroxycyclohexyl)methylammonio]methyl]-2-methoxy-phenoxy]propyl]-methyl-ammonium Formula: C25H44N2O4+2 MolecularWeight: 436.62786

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC(COC1=C(C=C(C=C1)C[NH2+]CC2(CCCCC2)O)OC)O)C3CCCCC3

Isomeric SMILES

C[NH+](C[C@H](COC1=C(C=C(C=C1)C[NH2+]CC2(CCCCC2)O)OC)O)C3CCCCC3

InChI

InChI=1S/C25H42N2O4/c1-27(21-9-5-3-6-10-21)17-22(28)18-31-23-12-11-20(15-24(23)30-2)16-26-19-25(29)13-7-4-8-14-25/h11-12,15,21-22,26,28-29H,3-10,13-14,16-19H2,1-2H3/p+2/t22-/m1/s1