methyl-[(2-methylphenyl)methyl]-[(2S)-2-oxidanyl-3-(4-phenylphenoxy)propyl]azanium

Systemtic Name: methyl-[(2-methylphenyl)methyl]-[(2S)-2-oxidanyl-3-(4-phenylphenoxy)propyl]azanium Openeye Name: [(2S)-2-hydroxy-3-(4-phenylphenoxy)propyl]-methyl-(o-tolylmethyl)ammonium CAS Name: [(2S)-2-hydroxy-3-(4-phenylphenoxy)propyl]-methyl-[(2-methylphenyl)methyl]ammonium IUPAC Name: [(2S)-2-hydroxy-3-(4-phenylphenoxy)propyl]-methyl-[(2-methylphenyl)methyl]azanium Traditional Name: [(2S)-2-hydroxy-3-(4-phenylphenoxy)propyl]-methyl-(2-methylbenzyl)ammonium Formula: C24H28NO2+ MolecularWeight: 362.48462

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C[NH+](C)CC(COC2=CC=C(C=C2)C3=CC=CC=C3)O

Isomeric SMILES

CC1=CC=CC=C1C[NH+](C)C[C@@H](COC2=CC=C(C=C2)C3=CC=CC=C3)O

InChI

InChI=1S/C24H27NO2/c1-19-8-6-7-11-22(19)16-25(2)17-23(26)18-27-24-14-12-21(13-15-24)20-9-4-3-5-10-20/h3-15,23,26H,16-18H2,1-2H3/p+1/t23-/m0/s1