5-(1,3-benzodioxol-4-yloxycarbonyl)-2,6-dimethyl-pyridine-3-carboxylic acid

Systemtic Name: 5-(1,3-benzodioxol-4-yloxycarbonyl)-2,6-dimethyl-pyridine-3-carboxylic acid Openeye Name: 5-(1,3-benzodioxol-4-yloxycarbonyl)-2,6-dimethyl-pyridine-3-carboxylic acid CAS Name: 5-[1,3-benzodioxol-4-yloxy(oxo)methyl]-2,6-dimethyl-3-pyridinecarboxylic acid IUPAC Name: 5-(1,3-benzodioxol-4-yloxycarbonyl)-2,6-dimethylpyridine-3-carboxylic acid Traditional Name: 5-(1,3-benzodioxol-4-yloxycarbonyl)-2,6-dimethyl-nicotinic acid Formula: C16H13NO6 MolecularWeight: 315.27752

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=N1)C)C(=O)O)C(=O)OC2=CC=CC3=C2OCO3

Isomeric SMILES

CC1=C(C=C(C(=N1)C)C(=O)O)C(=O)OC2=CC=CC3=C2OCO3

InChI

InChI=1S/C16H13NO6/c1-8-10(15(18)19)6-11(9(2)17-8)16(20)23-13-5-3-4-12-14(13)22-7-21-12/h3-6H,7H2,1-2H3,(H,18,19)