bis(2-hydroxyethyl)-[(2S)-3-(3-methylphenoxy)-2-oxidanyl-propyl]azanium

Systemtic Name: bis(2-hydroxyethyl)-[(2S)-3-(3-methylphenoxy)-2-oxidanyl-propyl]azanium Openeye Name: bis(2-hydroxyethyl)-[(2S)-2-hydroxy-3-(3-methylphenoxy)propyl]ammonium CAS Name: bis(2-hydroxyethyl)-[(2S)-2-hydroxy-3-(3-methylphenoxy)propyl]ammonium IUPAC Name: bis(2-hydroxyethyl)-[(2S)-2-hydroxy-3-(3-methylphenoxy)propyl]azanium Traditional Name: bis(2-hydroxyethyl)-[(2S)-2-hydroxy-3-(3-methylphenoxy)propyl]ammonium Formula: C14H24NO4+ MolecularWeight: 270.34466

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCC(C[NH+](CCO)CCO)O

Isomeric SMILES

CC1=CC(=CC=C1)OC[C@H](C[NH+](CCO)CCO)O

InChI

InChI=1S/C14H23NO4/c1-12-3-2-4-14(9-12)19-11-13(18)10-15(5-7-16)6-8-17/h2-4,9,13,16-18H,5-8,10-11H2,1H3/p+1/t13-/m0/s1