5-(1,3-dioxepan-2-yl)-2-(4-methyl-5-oxidanylidene-4-propan-2-yl-1H-imidazol-2-yl)pyridine-3-carboxylic acid

Systemtic Name: 5-(1,3-dioxepan-2-yl)-2-(4-methyl-5-oxidanylidene-4-propan-2-yl-1H-imidazol-2-yl)pyridine-3-carboxylic acid Openeye Name: 5-(1,3-dioxepan-2-yl)-2-(4-isopropyl-4-methyl-5-oxo-1H-imidazol-2-yl)pyridine-3-carboxylic acid CAS Name: 5-(1,3-dioxepan-2-yl)-2-(4-methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)-3-pyridinecarboxylic acid IUPAC Name: 5-(1,3-dioxepan-2-yl)-2-(4-methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)pyridine-3-carboxylic acid Traditional Name: 5-(1,3-dioxepan-2-yl)-2-(4-isopropyl-5-keto-4-methyl-2-imidazolin-2-yl)nicotinic acid Formula: C18H23N3O5 MolecularWeight: 361.39232

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1(C(=O)NC(=N1)C2=NC=C(C=C2C(=O)O)C3OCCCCO3)C

Isomeric SMILES

CC(C)C1(C(=O)NC(=N1)C2=NC=C(C=C2C(=O)O)C3OCCCCO3)C

InChI

InChI=1S/C18H23N3O5/c1-10(2)18(3)17(24)20-14(21-18)13-12(15(22)23)8-11(9-19-13)16-25-6-4-5-7-26-16/h8-10,16H,4-7H2,1-3H3,(H,22,23)(H,20,21,24)