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

Systemtic Name: [(2S)-3-(2-methylphenoxy)-2-oxidanyl-propyl]-(phenylmethyl)azanium Openeye Name: benzyl-[(2S)-2-hydroxy-3-(2-methylphenoxy)propyl]ammonium CAS Name: [(2S)-2-hydroxy-3-(2-methylphenoxy)propyl]-(phenylmethyl)ammonium IUPAC Name: benzyl-[(2S)-2-hydroxy-3-(2-methylphenoxy)propyl]azanium Traditional Name: benzyl-[(2S)-2-hydroxy-3-(2-methylphenoxy)propyl]ammonium Formula: C17H22NO2+ MolecularWeight: 272.36208

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCC(C[NH2+]CC2=CC=CC=C2)O

Isomeric SMILES

CC1=CC=CC=C1OC[C@H](C[NH2+]CC2=CC=CC=C2)O

InChI

InChI=1S/C17H21NO2/c1-14-7-5-6-10-17(14)20-13-16(19)12-18-11-15-8-3-2-4-9-15/h2-10,16,18-19H,11-13H2,1H3/p+1/t16-/m0/s1