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

Systemtic Name: 3-[4-(4-chlorophenyl)carbonyl-2,3-bis(oxidanylidene)-5-pyridin-3-yl-pyrrolidin-1-yl]propyl-dimethyl-azanium Openeye Name: 3-[4-(4-chlorobenzoyl)-2,3-dioxo-5-(3-pyridyl)pyrrolidin-1-yl]propyl-dimethyl-ammonium CAS Name: 3-[4-[(4-chlorophenyl)-oxomethyl]-2,3-dioxo-5-(3-pyridinyl)-1-pyrrolidinyl]propyl-dimethylammonium IUPAC Name: 3-[4-(4-chlorobenzoyl)-2,3-dioxo-5-pyridin-3-ylpyrrolidin-1-yl]propyl-dimethylazanium Traditional Name: 3-[4-(4-chlorobenzoyl)-2,3-diketo-5-(3-pyridyl)pyrrolidino]propyl-dimethyl-ammonium Formula: C21H23ClN3O3+ MolecularWeight: 400.87862

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22ClN3O3/c1-24(2)11-4-12-25-18(15-5-3-10-23-13-15)17(20(27)21(25)28)19(26)14-6-8-16(22)9-7-14/h3,5-10,13,17-18H,4,11-12H2,1-2H3/p+1