[(2S)-3-(3-chloranylphenoxy)-2-oxidanyl-propyl]-[(1S)-1-phenylethyl]azanium

Systemtic Name: [(2S)-3-(3-chloranylphenoxy)-2-oxidanyl-propyl]-[(1S)-1-phenylethyl]azanium Openeye Name: [(2S)-3-(3-chlorophenoxy)-2-hydroxy-propyl]-[(1S)-1-phenylethyl]ammonium CAS Name: [(2S)-3-(3-chlorophenoxy)-2-hydroxypropyl]-[(1S)-1-phenylethyl]ammonium IUPAC Name: [(2S)-3-(3-chlorophenoxy)-2-hydroxypropyl]-[(1S)-1-phenylethyl]azanium Traditional Name: [(2S)-3-(3-chlorophenoxy)-2-hydroxy-propyl]-[(1S)-1-phenylethyl]ammonium Formula: C17H21ClNO2+ MolecularWeight: 306.80714

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)[NH2+]CC(COC2=CC(=CC=C2)Cl)O

Isomeric SMILES

C[C@@H](C1=CC=CC=C1)[NH2+]C[C@@H](COC2=CC(=CC=C2)Cl)O

InChI

InChI=1S/C17H20ClNO2/c1-13(14-6-3-2-4-7-14)19-11-16(20)12-21-17-9-5-8-15(18)10-17/h2-10,13,16,19-20H,11-12H2,1H3/p+1/t13-,16-/m0/s1