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

Systemtic Name: [(2S)-4,5-bis(oxidanylidene)-1-pyridin-2-yl-2-pyridin-3-yl-pyrrolidin-3-ylidene]-(4-methoxyphenyl)methanolate Openeye Name: [(2S)-4,5-dioxo-1-(2-pyridyl)-2-(3-pyridyl)pyrrolidin-3-ylidene]-(4-methoxyphenyl)methanolate CAS Name: [(2S)-4,5-dioxo-1-(2-pyridinyl)-2-(3-pyridinyl)-3-pyrrolidinylidene]-(4-methoxyphenyl)methanolate IUPAC Name: [(2S)-4,5-dioxo-1-pyridin-2-yl-2-pyridin-3-ylpyrrolidin-3-ylidene]-(4-methoxyphenyl)methanolate Traditional Name: [(2S)-4,5-diketo-1-(2-pyridyl)-2-(3-pyridyl)pyrrolidin-3-ylidene]-(4-methoxyphenyl)methanolate Formula: C22H16N3O4- MolecularWeight: 386.38014

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)C3=CC=CC=N3)C4=CN=CC=C4)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)C(=C2[C@@H](N(C(=O)C2=O)C3=CC=CC=N3)C4=CN=CC=C4)[O-]

InChI

InChI=1S/C22H17N3O4/c1-29-16-9-7-14(8-10-16)20(26)18-19(15-5-4-11-23-13-15)25(22(28)21(18)27)17-6-2-3-12-24-17/h2-13,19,26H,1H3/p-1/t19-/m0/s1