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

Systemtic Name: [1-[2-(diethylazaniumyl)ethyl]-4,5-bis(oxidanylidene)-2-pyridin-3-yl-pyrrolidin-3-ylidene]-pyridin-4-yl-methanolate Openeye Name: [1-[2-(diethylammonio)ethyl]-4,5-dioxo-2-(3-pyridyl)pyrrolidin-3-ylidene]-(4-pyridyl)methanolate CAS Name: [1-[2-(diethylammonio)ethyl]-4,5-dioxo-2-(3-pyridinyl)-3-pyrrolidinylidene]-pyridin-4-ylmethanolate IUPAC Name: [1-[2-(diethylazaniumyl)ethyl]-4,5-dioxo-2-pyridin-3-ylpyrrolidin-3-ylidene]-pyridin-4-ylmethanolate Traditional Name: [1-[2-(diethylammonio)ethyl]-4,5-diketo-2-(3-pyridyl)pyrrolidin-3-ylidene]-(4-pyridyl)methanolate Formula: C21H24N4O3 MolecularWeight: 380.44026

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24N4O3/c1-3-24(4-2)12-13-25-18(16-6-5-9-23-14-16)17(20(27)21(25)28)19(26)15-7-10-22-11-8-15/h5-11,14,18,26H,3-4,12-13H2,1-2H3