[3-methoxy-4-[(2S)-2-oxidanyl-2-phenyl-ethoxy]phenyl]methyl-(phenylmethyl)azanium

Systemtic Name: [3-methoxy-4-[(2S)-2-oxidanyl-2-phenyl-ethoxy]phenyl]methyl-(phenylmethyl)azanium Openeye Name: benzyl-[[4-[(2S)-2-hydroxy-2-phenyl-ethoxy]-3-methoxy-phenyl]methyl]ammonium CAS Name: [4-[(2S)-2-hydroxy-2-phenylethoxy]-3-methoxyphenyl]methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[[4-[(2S)-2-hydroxy-2-phenylethoxy]-3-methoxyphenyl]methyl]azanium Traditional Name: benzyl-[4-[(2S)-2-hydroxy-2-phenyl-ethoxy]-3-methoxy-benzyl]ammonium Formula: C23H26NO3+ MolecularWeight: 364.45744

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C[NH2+]CC2=CC=CC=C2)OCC(C3=CC=CC=C3)O

Isomeric SMILES

COC1=C(C=CC(=C1)C[NH2+]CC2=CC=CC=C2)OC[C@H](C3=CC=CC=C3)O

InChI

InChI=1S/C23H25NO3/c1-26-23-14-19(16-24-15-18-8-4-2-5-9-18)12-13-22(23)27-17-21(25)20-10-6-3-7-11-20/h2-14,21,24-25H,15-17H2,1H3/p+1/t21-/m1/s1