tert-butyl-[(4-methoxyphenyl)methyl]-[(2S)-3-[(3-methyl-1H-indol-4-yl)oxy]-2-oxidanyl-propyl]azanium

Systemtic Name: tert-butyl-[(4-methoxyphenyl)methyl]-[(2S)-3-[(3-methyl-1H-indol-4-yl)oxy]-2-oxidanyl-propyl]azanium Openeye Name: tert-butyl-[(2S)-2-hydroxy-3-[(3-methyl-1H-indol-4-yl)oxy]propyl]-[(4-methoxyphenyl)methyl]ammonium CAS Name: tert-butyl-[(2S)-2-hydroxy-3-[(3-methyl-1H-indol-4-yl)oxy]propyl]-[(4-methoxyphenyl)methyl]ammonium IUPAC Name: tert-butyl-[(2S)-2-hydroxy-3-[(3-methyl-1H-indol-4-yl)oxy]propyl]-[(4-methoxyphenyl)methyl]azanium Traditional Name: tert-butyl-[(2S)-2-hydroxy-3-[(3-methyl-1H-indol-4-yl)oxy]propyl]-p-anisyl-ammonium Formula: C24H33N2O3+ MolecularWeight: 397.53042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CNC2=C1C(=CC=C2)OCC(C[NH+](CC3=CC=C(C=C3)OC)C(C)(C)C)O

Isomeric SMILES

CC1=CNC2=C1C(=CC=C2)OC[C@H](C[NH+](CC3=CC=C(C=C3)OC)C(C)(C)C)O

InChI

InChI=1S/C24H32N2O3/c1-17-13-25-21-7-6-8-22(23(17)21)29-16-19(27)15-26(24(2,3)4)14-18-9-11-20(28-5)12-10-18/h6-13,19,25,27H,14-16H2,1-5H3/p+1/t19-/m0/s1