4-[4-(piperidin-1-ium-1-ylmethyl)phenyl]carbonyl-1,3-dihydroquinoxalin-2-one

Systemtic Name: 4-[4-(piperidin-1-ium-1-ylmethyl)phenyl]carbonyl-1,3-dihydroquinoxalin-2-one Openeye Name: 4-[4-(piperidin-1-ium-1-ylmethyl)benzoyl]-1,3-dihydroquinoxalin-2-one CAS Name: 4-[oxo-[4-(1-piperidin-1-iumylmethyl)phenyl]methyl]-1,3-dihydroquinoxalin-2-one IUPAC Name: 4-[4-(piperidin-1-ium-1-ylmethyl)benzoyl]-1,3-dihydroquinoxalin-2-one Traditional Name: 4-[4-(piperidin-1-ium-1-ylmethyl)benzoyl]-1,3-dihydroquinoxalin-2-one Formula: C21H24N3O2+ MolecularWeight: 350.43416

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC2=CC=C(C=C2)C(=O)N3CC(=O)NC4=CC=CC=C43

Isomeric SMILES

C1CC[NH+](CC1)CC2=CC=C(C=C2)C(=O)N3CC(=O)NC4=CC=CC=C43

InChI

InChI=1S/C21H23N3O2/c25-20-15-24(19-7-3-2-6-18(19)22-20)21(26)17-10-8-16(9-11-17)14-23-12-4-1-5-13-23/h2-3,6-11H,1,4-5,12-15H2,(H,22,25)/p+1