3-[1-[(2R)-1-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]piperidin-1-ium-4-yl]-1H-benzimidazol-2-one

Systemtic Name: 3-[1-[(2R)-1-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]piperidin-1-ium-4-yl]-1H-benzimidazol-2-one Openeye Name: 3-[1-[(1R)-2-(1H-indol-3-yl)-1-methyl-2-oxo-ethyl]piperidin-1-ium-4-yl]-1H-benzimidazol-2-one CAS Name: 3-[1-[(2R)-1-(1H-indol-3-yl)-1-oxopropan-2-yl]-4-piperidin-1-iumyl]-1H-benzimidazol-2-one IUPAC Name: 3-[1-[(2R)-1-(1H-indol-3-yl)-1-oxopropan-2-yl]piperidin-1-ium-4-yl]-1H-benzimidazol-2-one Traditional Name: 3-[1-[(1R)-2-(1H-indol-3-yl)-2-keto-1-methyl-ethyl]piperidin-1-ium-4-yl]-1H-benzimidazol-2-one Formula: C23H25N4O2+ MolecularWeight: 389.4702

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CNC2=CC=CC=C21)[NH+]3CCC(CC3)N4C5=CC=CC=C5NC4=O

Isomeric SMILES

C[C@H](C(=O)C1=CNC2=CC=CC=C21)[NH+]3CCC(CC3)N4C5=CC=CC=C5NC4=O

InChI

InChI=1S/C23H24N4O2/c1-15(22(28)18-14-24-19-7-3-2-6-17(18)19)26-12-10-16(11-13-26)27-21-9-5-4-8-20(21)25-23(27)29/h2-9,14-16,24H,10-13H2,1H3,(H,25,29)/p+1/t15-/m1/s1