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

Systemtic Name: [(2S)-1-(4-ethanoylpiperazin-1-yl)-3-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]azanium Openeye Name: [(1S)-2-(4-acetylpiperazin-1-yl)-1-(1H-indol-3-ylmethyl)-2-oxo-ethyl]ammonium CAS Name: [(2S)-1-(4-acetyl-1-piperazinyl)-3-(1H-indol-3-yl)-1-oxopropan-2-yl]ammonium IUPAC Name: [(2S)-1-(4-acetylpiperazin-1-yl)-3-(1H-indol-3-yl)-1-oxopropan-2-yl]azanium Traditional Name: [(1S)-2-(4-acetylpiperazino)-1-(1H-indol-3-ylmethyl)-2-keto-ethyl]ammonium Formula: C17H23N4O2+ MolecularWeight: 315.39012

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C(=O)C(CC2=CNC3=CC=CC=C32)[NH3+]

Isomeric SMILES

CC(=O)N1CCN(CC1)C(=O)[C@H](CC2=CNC3=CC=CC=C32)[NH3+]

InChI

InChI=1S/C17H22N4O2/c1-12(22)20-6-8-21(9-7-20)17(23)15(18)10-13-11-19-16-5-3-2-4-14(13)16/h2-5,11,15,19H,6-10,18H2,1H3/p+1/t15-/m0/s1