[(2S)-3-(1H-indol-3-yl)-1-oxidanylidene-1-(pyridin-2-ylmethylamino)propan-2-yl]azanium chloride

Systemtic Name: [(2S)-3-(1H-indol-3-yl)-1-oxidanylidene-1-(pyridin-2-ylmethylamino)propan-2-yl]azanium chloride Openeye Name: [(1S)-1-(1H-indol-3-ylmethyl)-2-oxo-2-(2-pyridylmethylamino)ethyl]ammonium chloride CAS Name: [(2S)-3-(1H-indol-3-yl)-1-oxo-1-(2-pyridinylmethylamino)propan-2-yl]ammonium chloride IUPAC Name: [(2S)-3-(1H-indol-3-yl)-1-oxo-1-(pyridin-2-ylmethylamino)propan-2-yl]azanium chloride Traditional Name: [(1S)-1-(1H-indol-3-ylmethyl)-2-keto-2-(2-pyridylmethylamino)ethyl]ammonium chloride Formula: C17H19ClN4O MolecularWeight: 330.81196

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CC(C(=O)NCC3=CC=CC=N3)[NH3+].[Cl-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)C[C@@H](C(=O)NCC3=CC=CC=N3)[NH3+].[Cl-]

InChI

InChI=1S/C17H18N4O.ClH/c18-15(17(22)21-11-13-5-3-4-8-19-13)9-12-10-20-16-7-2-1-6-14(12)16;/h1-8,10,15,20H,9,11,18H2,(H,21,22);1H/t15-;/m0./s1