[(2S)-3-(1H-indol-3-yl)-1-oxidanylidene-1-[(4-propan-2-yloxyphenyl)amino]propan-2-yl]azanium

Systemtic Name: [(2S)-3-(1H-indol-3-yl)-1-oxidanylidene-1-[(4-propan-2-yloxyphenyl)amino]propan-2-yl]azanium Openeye Name: [(1S)-1-(1H-indol-3-ylmethyl)-2-(4-isopropoxyanilino)-2-oxo-ethyl]ammonium CAS Name: [(2S)-3-(1H-indol-3-yl)-1-oxo-1-(4-propan-2-yloxyanilino)propan-2-yl]ammonium IUPAC Name: [(2S)-3-(1H-indol-3-yl)-1-oxo-1-(4-propan-2-yloxyanilino)propan-2-yl]azanium Traditional Name: [(1S)-1-(1H-indol-3-ylmethyl)-2-(4-isopropoxyanilino)-2-keto-ethyl]ammonium Formula: C20H24N3O2+ MolecularWeight: 338.42346

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)NC(=O)C(CC2=CNC3=CC=CC=C32)[NH3+]

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)NC(=O)[C@H](CC2=CNC3=CC=CC=C32)[NH3+]

InChI

InChI=1S/C20H23N3O2/c1-13(2)25-16-9-7-15(8-10-16)23-20(24)18(21)11-14-12-22-19-6-4-3-5-17(14)19/h3-10,12-13,18,22H,11,21H2,1-2H3,(H,23,24)/p+1/t18-/m0/s1