[(2S)-3-(4-chloranyl-2-methyl-phenoxy)-2-oxidanyl-propyl]-bis(2-hydroxyethyl)azanium

Systemtic Name: [(2S)-3-(4-chloranyl-2-methyl-phenoxy)-2-oxidanyl-propyl]-bis(2-hydroxyethyl)azanium Openeye Name: [(2S)-3-(4-chloro-2-methyl-phenoxy)-2-hydroxy-propyl]-bis(2-hydroxyethyl)ammonium CAS Name: [(2S)-3-(4-chloro-2-methylphenoxy)-2-hydroxypropyl]-bis(2-hydroxyethyl)ammonium IUPAC Name: [(2S)-3-(4-chloro-2-methylphenoxy)-2-hydroxypropyl]-bis(2-hydroxyethyl)azanium Traditional Name: [(2S)-3-(4-chloro-2-methyl-phenoxy)-2-hydroxy-propyl]-bis(2-hydroxyethyl)ammonium Formula: C14H23ClNO4+ MolecularWeight: 304.78972

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H22ClNO4/c1-11-8-12(15)2-3-14(11)20-10-13(19)9-16(4-6-17)5-7-18/h2-3,8,13,17-19H,4-7,9-10H2,1H3/p+1/t13-/m0/s1