[(2R)-3-(4-methylphenoxy)-2-oxidanyl-propyl]-phenethyl-(phenylmethyl)azanium

Systemtic Name: [(2R)-3-(4-methylphenoxy)-2-oxidanyl-propyl]-phenethyl-(phenylmethyl)azanium Openeye Name: benzyl-[(2R)-2-hydroxy-3-(4-methylphenoxy)propyl]-phenethyl-ammonium CAS Name: [(2R)-2-hydroxy-3-(4-methylphenoxy)propyl]-phenethyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[(2R)-2-hydroxy-3-(4-methylphenoxy)propyl]-phenethylazanium Traditional Name: benzyl-[(2R)-2-hydroxy-3-(4-methylphenoxy)propyl]-phenethyl-ammonium Formula: C25H30NO2+ MolecularWeight: 376.5112

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCC(C[NH+](CCC2=CC=CC=C2)CC3=CC=CC=C3)O

Isomeric SMILES

CC1=CC=C(C=C1)OC[C@@H](C[NH+](CCC2=CC=CC=C2)CC3=CC=CC=C3)O

InChI

InChI=1S/C25H29NO2/c1-21-12-14-25(15-13-21)28-20-24(27)19-26(18-23-10-6-3-7-11-23)17-16-22-8-4-2-5-9-22/h2-15,24,27H,16-20H2,1H3/p+1/t24-/m1/s1