[(2R)-1-(3-imidazol-1-ylpropyl)-4,5-bis(oxidanylidene)-2-pyridin-4-yl-pyrrolidin-3-ylidene]-phenyl-methanolate

Systemtic Name: [(2R)-1-(3-imidazol-1-ylpropyl)-4,5-bis(oxidanylidene)-2-pyridin-4-yl-pyrrolidin-3-ylidene]-phenyl-methanolate Openeye Name: [(2R)-1-(3-imidazol-1-ylpropyl)-4,5-dioxo-2-(4-pyridyl)pyrrolidin-3-ylidene]-phenyl-methanolate CAS Name: [(2R)-1-[3-(1-imidazolyl)propyl]-4,5-dioxo-2-pyridin-4-yl-3-pyrrolidinylidene]-phenylmethanolate IUPAC Name: [(2R)-1-(3-imidazol-1-ylpropyl)-4,5-dioxo-2-pyridin-4-ylpyrrolidin-3-ylidene]-phenylmethanolate Traditional Name: [(2R)-1-(3-imidazol-1-ylpropyl)-4,5-diketo-2-(4-pyridyl)pyrrolidin-3-ylidene]-phenyl-methanolate Formula: C22H19N4O3- MolecularWeight: 387.41126

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)CCCN3C=CN=C3)C4=CC=NC=C4)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(=C2[C@H](N(C(=O)C2=O)CCCN3C=CN=C3)C4=CC=NC=C4)[O-]

InChI

InChI=1S/C22H20N4O3/c27-20(17-5-2-1-3-6-17)18-19(16-7-9-23-10-8-16)26(22(29)21(18)28)13-4-12-25-14-11-24-15-25/h1-3,5-11,14-15,19,27H,4,12-13H2/p-1/t19-/m1/s1