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

Systemtic Name: [(2S)-3-(1H-indol-3-yl)-1-oxidanylidene-1-(pyridin-4-ylmethylamino)propan-2-yl]azanium chloride Openeye Name: [(1S)-1-(1H-indol-3-ylmethyl)-2-oxo-2-(4-pyridylmethylamino)ethyl]ammonium chloride CAS Name: [(2S)-3-(1H-indol-3-yl)-1-oxo-1-(pyridin-4-ylmethylamino)propan-2-yl]ammonium chloride IUPAC Name: [(2S)-3-(1H-indol-3-yl)-1-oxo-1-(pyridin-4-ylmethylamino)propan-2-yl]azanium chloride Traditional Name: [(1S)-1-(1H-indol-3-ylmethyl)-2-keto-2-(4-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=NC=C3)[NH3+].[Cl-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)C[C@@H](C(=O)NCC3=CC=NC=C3)[NH3+].[Cl-]

InChI

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