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

Systemtic Name: cyclohexyl-methyl-[(2S)-2-oxidanyl-3-[3-[[(1-oxidanylcyclohexyl)methylazaniumyl]methyl]phenoxy]propyl]azanium Openeye Name: cyclohexyl-[(2S)-2-hydroxy-3-[3-[[(1-hydroxycyclohexyl)methylammonio]methyl]phenoxy]propyl]-methyl-ammonium CAS Name: cyclohexyl-[(2S)-2-hydroxy-3-[3-[[(1-hydroxycyclohexyl)methylammonio]methyl]phenoxy]propyl]-methylammonium IUPAC Name: cyclohexyl-[(2S)-2-hydroxy-3-[3-[[(1-hydroxycyclohexyl)methylazaniumyl]methyl]phenoxy]propyl]-methylazanium Traditional Name: cyclohexyl-[(2S)-2-hydroxy-3-[3-[[(1-hydroxycyclohexyl)methylammonio]methyl]phenoxy]propyl]-methyl-ammonium Formula: C24H42N2O3+2 MolecularWeight: 406.60188

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H40N2O3/c1-26(21-10-4-2-5-11-21)17-22(27)18-29-23-12-8-9-20(15-23)16-25-19-24(28)13-6-3-7-14-24/h8-9,12,15,21-22,25,27-28H,2-7,10-11,13-14,16-19H2,1H3/p+2/t22-/m0/s1