3-[2,3-bis(oxidanylidene)-4-(phenylcarbonyl)-5-pyridin-3-yl-pyrrolidin-1-yl]propyl-dimethyl-azanium

Systemtic Name: 3-[2,3-bis(oxidanylidene)-4-(phenylcarbonyl)-5-pyridin-3-yl-pyrrolidin-1-yl]propyl-dimethyl-azanium Openeye Name: 3-[4-benzoyl-2,3-dioxo-5-(3-pyridyl)pyrrolidin-1-yl]propyl-dimethyl-ammonium CAS Name: 3-[4-benzoyl-2,3-dioxo-5-(3-pyridinyl)-1-pyrrolidinyl]propyl-dimethylammonium IUPAC Name: 3-(4-benzoyl-2,3-dioxo-5-pyridin-3-ylpyrrolidin-1-yl)propyl-dimethylazanium Traditional Name: 3-[4-benzoyl-2,3-diketo-5-(3-pyridyl)pyrrolidino]propyl-dimethyl-ammonium Formula: C21H24N3O3+ MolecularWeight: 366.43356

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCN1C(C(C(=O)C1=O)C(=O)C2=CC=CC=C2)C3=CN=CC=C3

Isomeric SMILES

C[NH+](C)CCCN1C(C(C(=O)C1=O)C(=O)C2=CC=CC=C2)C3=CN=CC=C3

InChI

InChI=1S/C21H23N3O3/c1-23(2)12-7-13-24-18(16-10-6-11-22-14-16)17(20(26)21(24)27)19(25)15-8-4-3-5-9-15/h3-6,8-11,14,17-18H,7,12-13H2,1-2H3/p+1