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

Systemtic Name: [1-[2-(dimethylazaniumyl)ethyl]-4,5-bis(oxidanylidene)-2-thiophen-2-yl-pyrrolidin-3-ylidene]-pyridin-4-yl-methanolate Openeye Name: [1-[2-(dimethylammonio)ethyl]-4,5-dioxo-2-(2-thienyl)pyrrolidin-3-ylidene]-(4-pyridyl)methanolate CAS Name: [1-[2-(dimethylammonio)ethyl]-4,5-dioxo-2-thiophen-2-yl-3-pyrrolidinylidene]-pyridin-4-ylmethanolate IUPAC Name: [1-[2-(dimethylazaniumyl)ethyl]-4,5-dioxo-2-thiophen-2-ylpyrrolidin-3-ylidene]-pyridin-4-ylmethanolate Traditional Name: [1-[2-(dimethylammonio)ethyl]-4,5-diketo-2-(2-thienyl)pyrrolidin-3-ylidene]-(4-pyridyl)methanolate Formula: C18H19N3O3S MolecularWeight: 357.42676

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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=CS3

Isomeric SMILES

C[NH+](C)CCN1C(C(=C(C2=CC=NC=C2)[O-])C(=O)C1=O)C3=CC=CS3

InChI

InChI=1S/C18H19N3O3S/c1-20(2)9-10-21-15(13-4-3-11-25-13)14(17(23)18(21)24)16(22)12-5-7-19-8-6-12/h3-8,11,15,22H,9-10H2,1-2H3