sodium 5-(1,3-dioxolan-2-yl)-2-(4-methyl-5-oxidanylidene-4-propan-2-yl-1H-imidazol-2-yl)pyridine-3-carboxylate

Systemtic Name: sodium 5-(1,3-dioxolan-2-yl)-2-(4-methyl-5-oxidanylidene-4-propan-2-yl-1H-imidazol-2-yl)pyridine-3-carboxylate Openeye Name: sodium 5-(1,3-dioxolan-2-yl)-2-(4-isopropyl-4-methyl-5-oxo-1H-imidazol-2-yl)pyridine-3-carboxylate CAS Name: sodium 5-(1,3-dioxolan-2-yl)-2-(4-methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)-3-pyridinecarboxylate IUPAC Name: sodium 5-(1,3-dioxolan-2-yl)-2-(4-methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)pyridine-3-carboxylate Traditional Name: sodium 5-(1,3-dioxolan-2-yl)-2-(4-isopropyl-5-keto-4-methyl-2-imidazolin-2-yl)nicotinate Formula: C16H18N3NaO5 MolecularWeight: 355.32099

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1(C(=O)NC(=N1)C2=NC=C(C=C2C(=O)[O-])C3OCCO3)C.[Na+]

Isomeric SMILES

CC(C)C1(C(=O)NC(=N1)C2=NC=C(C=C2C(=O)[O-])C3OCCO3)C.[Na+]

InChI

InChI=1S/C16H19N3O5.Na/c1-8(2)16(3)15(22)18-12(19-16)11-10(13(20)21)6-9(7-17-11)14-23-4-5-24-14;/h6-8,14H,4-5H2,1-3H3,(H,20,21)(H,18,19,22);/q;+1/p-1