[1-[2-(dimethylazaniumyl)ethyl]-4,5-bis(oxidanylidene)-2-phenyl-pyrrolidin-3-ylidene]-pyridin-4-yl-methanolate

Systemtic Name: [1-[2-(dimethylazaniumyl)ethyl]-4,5-bis(oxidanylidene)-2-phenyl-pyrrolidin-3-ylidene]-pyridin-4-yl-methanolate Openeye Name: [1-[2-(dimethylammonio)ethyl]-4,5-dioxo-2-phenyl-pyrrolidin-3-ylidene]-(4-pyridyl)methanolate CAS Name: [1-[2-(dimethylammonio)ethyl]-4,5-dioxo-2-phenyl-3-pyrrolidinylidene]-pyridin-4-ylmethanolate IUPAC Name: [1-[2-(dimethylazaniumyl)ethyl]-4,5-dioxo-2-phenylpyrrolidin-3-ylidene]-pyridin-4-ylmethanolate Traditional Name: [1-[2-(dimethylammonio)ethyl]-4,5-diketo-2-phenyl-pyrrolidin-3-ylidene]-(4-pyridyl)methanolate Formula: C20H21N3O3 MolecularWeight: 351.39904

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCN1C(C(=C(C2=CC=NC=C2)[O-])C(=O)C1=O)C3=CC=CC=C3

Isomeric SMILES

C[NH+](C)CCN1C(C(=C(C2=CC=NC=C2)[O-])C(=O)C1=O)C3=CC=CC=C3

InChI

InChI=1S/C20H21N3O3/c1-22(2)12-13-23-17(14-6-4-3-5-7-14)16(19(25)20(23)26)18(24)15-8-10-21-11-9-15/h3-11,17,24H,12-13H2,1-2H3