(3R)-1-[2-[2-(1H-indol-3-yl)ethylamino]-2-oxidanylidene-ethyl]piperidin-1-ium-3-carboxamide

Systemtic Name: (3R)-1-[2-[2-(1H-indol-3-yl)ethylamino]-2-oxidanylidene-ethyl]piperidin-1-ium-3-carboxamide Openeye Name: (3R)-1-[2-[2-(1H-indol-3-yl)ethylamino]-2-oxo-ethyl]piperidin-1-ium-3-carboxamide CAS Name: (3R)-1-[2-[2-(1H-indol-3-yl)ethylamino]-2-oxoethyl]-3-piperidin-1-iumcarboxamide IUPAC Name: (3R)-1-[2-[2-(1H-indol-3-yl)ethylamino]-2-oxoethyl]piperidin-1-ium-3-carboxamide Traditional Name: (3R)-1-[2-[2-(1H-indol-3-yl)ethylamino]-2-keto-ethyl]piperidin-1-ium-3-carboxamide Formula: C18H25N4O2+ MolecularWeight: 329.4167

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CC(=O)NCCC2=CNC3=CC=CC=C32)C(=O)N

Isomeric SMILES

C1C[C@H](C[NH+](C1)CC(=O)NCCC2=CNC3=CC=CC=C32)C(=O)N

InChI

InChI=1S/C18H24N4O2/c19-18(24)14-4-3-9-22(11-14)12-17(23)20-8-7-13-10-21-16-6-2-1-5-15(13)16/h1-2,5-6,10,14,21H,3-4,7-9,11-12H2,(H2,19,24)(H,20,23)/p+1/t14-/m1/s1