(3-methoxy-4-phenethyloxy-phenyl)methyl-[(2S)-2-oxidanyl-2-phenyl-ethyl]azanium

Systemtic Name: (3-methoxy-4-phenethyloxy-phenyl)methyl-[(2S)-2-oxidanyl-2-phenyl-ethyl]azanium Openeye Name: [(2S)-2-hydroxy-2-phenyl-ethyl]-[(3-methoxy-4-phenethyloxy-phenyl)methyl]ammonium CAS Name: [(2S)-2-hydroxy-2-phenylethyl]-[(3-methoxy-4-phenethyloxyphenyl)methyl]ammonium IUPAC Name: [(2S)-2-hydroxy-2-phenylethyl]-[(3-methoxy-4-phenethyloxyphenyl)methyl]azanium Traditional Name: [(2S)-2-hydroxy-2-phenyl-ethyl]-(3-methoxy-4-phenethyloxy-benzyl)ammonium Formula: C24H28NO3+ MolecularWeight: 378.48402

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C[NH2+]CC(C2=CC=CC=C2)O)OCCC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=CC(=C1)C[NH2+]C[C@H](C2=CC=CC=C2)O)OCCC3=CC=CC=C3

InChI

InChI=1S/C24H27NO3/c1-27-24-16-20(17-25-18-22(26)21-10-6-3-7-11-21)12-13-23(24)28-15-14-19-8-4-2-5-9-19/h2-13,16,22,25-26H,14-15,17-18H2,1H3/p+1/t22-/m1/s1