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

Systemtic Name: [1-[3-(diethylazaniumyl)propyl]-4,5-bis(oxidanylidene)-2-phenyl-pyrrolidin-3-ylidene]-pyridin-4-yl-methanolate Openeye Name: [1-[3-(diethylammonio)propyl]-4,5-dioxo-2-phenyl-pyrrolidin-3-ylidene]-(4-pyridyl)methanolate CAS Name: [1-[3-(diethylammonio)propyl]-4,5-dioxo-2-phenyl-3-pyrrolidinylidene]-pyridin-4-ylmethanolate IUPAC Name: [1-[3-(diethylazaniumyl)propyl]-4,5-dioxo-2-phenylpyrrolidin-3-ylidene]-pyridin-4-ylmethanolate Traditional Name: [1-[3-(diethylammonio)propyl]-4,5-diketo-2-phenyl-pyrrolidin-3-ylidene]-(4-pyridyl)methanolate Formula: C23H27N3O3 MolecularWeight: 393.47878

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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