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

Systemtic Name: 3-[2,3-bis(oxidanylidene)-4-(phenylcarbonyl)-5-pyridin-2-yl-pyrrolidin-1-yl]propyl-diethyl-azanium Openeye Name: 3-[4-benzoyl-2,3-dioxo-5-(2-pyridyl)pyrrolidin-1-yl]propyl-diethyl-ammonium CAS Name: 3-[4-benzoyl-2,3-dioxo-5-(2-pyridinyl)-1-pyrrolidinyl]propyl-diethylammonium IUPAC Name: 3-(4-benzoyl-2,3-dioxo-5-pyridin-2-ylpyrrolidin-1-yl)propyl-diethylazanium Traditional Name: 3-[4-benzoyl-2,3-diketo-5-(2-pyridyl)pyrrolidino]propyl-diethyl-ammonium Formula: C23H28N3O3+ MolecularWeight: 394.48672

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCN1C(C(C(=O)C1=O)C(=O)C2=CC=CC=C2)C3=CC=CC=N3

Isomeric SMILES

CC[NH+](CC)CCCN1C(C(C(=O)C1=O)C(=O)C2=CC=CC=C2)C3=CC=CC=N3

InChI

InChI=1S/C23H27N3O3/c1-3-25(4-2)15-10-16-26-20(18-13-8-9-14-24-18)19(22(28)23(26)29)21(27)17-11-6-5-7-12-17/h5-9,11-14,19-20H,3-4,10,15-16H2,1-2H3/p+1