4-[(2R)-2-[4-(2-oxidanylidene-3H-benzimidazol-1-yl)piperidin-1-ium-1-yl]propanoyl]-1,3-dihydroquinoxalin-2-one

Systemtic Name: 4-[(2R)-2-[4-(2-oxidanylidene-3H-benzimidazol-1-yl)piperidin-1-ium-1-yl]propanoyl]-1,3-dihydroquinoxalin-2-one Openeye Name: 4-[(2R)-2-[4-(2-oxo-3H-benzimidazol-1-yl)piperidin-1-ium-1-yl]propanoyl]-1,3-dihydroquinoxalin-2-one CAS Name: 4-[(2R)-1-oxo-2-[4-(2-oxo-3H-benzimidazol-1-yl)-1-piperidin-1-iumyl]propyl]-1,3-dihydroquinoxalin-2-one IUPAC Name: 4-[(2R)-2-[4-(2-oxo-3H-benzimidazol-1-yl)piperidin-1-ium-1-yl]propanoyl]-1,3-dihydroquinoxalin-2-one Traditional Name: 4-[(2R)-2-[4-(2-keto-3H-benzimidazol-1-yl)piperidin-1-ium-1-yl]propanoyl]-1,3-dihydroquinoxalin-2-one Formula: C23H26N5O3+ MolecularWeight: 420.48424

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CC(=O)NC2=CC=CC=C21)[NH+]3CCC(CC3)N4C5=CC=CC=C5NC4=O

Isomeric SMILES

C[C@H](C(=O)N1CC(=O)NC2=CC=CC=C21)[NH+]3CCC(CC3)N4C5=CC=CC=C5NC4=O

InChI

InChI=1S/C23H25N5O3/c1-15(22(30)27-14-21(29)24-17-6-2-4-8-19(17)27)26-12-10-16(11-13-26)28-20-9-5-3-7-18(20)25-23(28)31/h2-9,15-16H,10-14H2,1H3,(H,24,29)(H,25,31)/p+1/t15-/m1/s1