4-(2,1,3-benzoxadiazol-4-yl)-2,6-dimethyl-5-propan-2-yloxycarbonyl-pyridine-3-carboxylic acid

Systemtic Name: 4-(2,1,3-benzoxadiazol-4-yl)-2,6-dimethyl-5-propan-2-yloxycarbonyl-pyridine-3-carboxylic acid Openeye Name: 4-(2,1,3-benzoxadiazol-4-yl)-5-isopropoxycarbonyl-2,6-dimethyl-pyridine-3-carboxylic acid CAS Name: 4-(2,1,3-benzoxadiazol-4-yl)-2,6-dimethyl-5-[oxo(propan-2-yloxy)methyl]-3-pyridinecarboxylic acid IUPAC Name: 4-(2,1,3-benzoxadiazol-4-yl)-2,6-dimethyl-5-propan-2-yloxycarbonylpyridine-3-carboxylic acid Traditional Name: 4-benzofurazan-4-yl-5-isopropoxycarbonyl-2,6-dimethyl-nicotinic acid Formula: C18H17N3O5 MolecularWeight: 355.34468

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=N1)C)C(=O)O)C2=CC=CC3=NON=C32)C(=O)OC(C)C

Isomeric SMILES

CC1=C(C(=C(C(=N1)C)C(=O)O)C2=CC=CC3=NON=C32)C(=O)OC(C)C

InChI

InChI=1S/C18H17N3O5/c1-8(2)25-18(24)14-10(4)19-9(3)13(17(22)23)15(14)11-6-5-7-12-16(11)21-26-20-12/h5-8H,1-4H3,(H,22,23)