bis(2-hydroxyethyl)-[(2S)-2-oxidanyl-3-(4-propanoylphenoxy)propyl]azanium

Systemtic Name: bis(2-hydroxyethyl)-[(2S)-2-oxidanyl-3-(4-propanoylphenoxy)propyl]azanium Openeye Name: bis(2-hydroxyethyl)-[(2S)-2-hydroxy-3-(4-propanoylphenoxy)propyl]ammonium CAS Name: bis(2-hydroxyethyl)-[(2S)-2-hydroxy-3-[4-(1-oxopropyl)phenoxy]propyl]ammonium IUPAC Name: bis(2-hydroxyethyl)-[(2S)-2-hydroxy-3-(4-propanoylphenoxy)propyl]azanium Traditional Name: bis(2-hydroxyethyl)-[(2S)-2-hydroxy-3-(4-propionylphenoxy)propyl]ammonium Formula: C16H26NO5+ MolecularWeight: 312.38134

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H25NO5/c1-2-16(21)13-3-5-15(6-4-13)22-12-14(20)11-17(7-9-18)8-10-19/h3-6,14,18-20H,2,7-12H2,1H3/p+1/t14-/m0/s1