methyl-[(2S)-2-oxidanyl-3-(2-phenoxyethoxy)propyl]azanium

Systemtic Name: methyl-[(2S)-2-oxidanyl-3-(2-phenoxyethoxy)propyl]azanium Openeye Name: [(2S)-2-hydroxy-3-(2-phenoxyethoxy)propyl]-methyl-ammonium CAS Name: [(2S)-2-hydroxy-3-(2-phenoxyethoxy)propyl]-methylammonium IUPAC Name: [(2S)-2-hydroxy-3-(2-phenoxyethoxy)propyl]-methylazanium Traditional Name: [(2S)-2-hydroxy-3-(2-phenoxyethoxy)propyl]-methyl-ammonium Formula: C12H20NO3+ MolecularWeight: 226.2921

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Descriptors Computed from Structure

Canonical SMILES:

C[NH2+]CC(COCCOC1=CC=CC=C1)O

Isomeric SMILES

C[NH2+]C[C@@H](COCCOC1=CC=CC=C1)O

InChI

InChI=1S/C12H19NO3/c1-13-9-11(14)10-15-7-8-16-12-5-3-2-4-6-12/h2-6,11,13-14H,7-10H2,1H3/p+1/t11-/m0/s1