3-[[3-bromanyl-2-(methoxymethyl)-6-methyl-phenyl]carbamoyl]-6-methyl-pyridine-2-carboxylic acid

Systemtic Name: 3-[[3-bromanyl-2-(methoxymethyl)-6-methyl-phenyl]carbamoyl]-6-methyl-pyridine-2-carboxylic acid Openeye Name: 3-[[3-bromo-2-(methoxymethyl)-6-methyl-phenyl]carbamoyl]-6-methyl-pyridine-2-carboxylic acid CAS Name: 3-[[3-bromo-2-(methoxymethyl)-6-methylanilino]-oxomethyl]-6-methyl-2-pyridinecarboxylic acid IUPAC Name: 3-[[3-bromo-2-(methoxymethyl)-6-methylphenyl]carbamoyl]-6-methylpyridine-2-carboxylic acid Traditional Name: 3-[[3-bromo-2-(methoxymethyl)-6-methyl-phenyl]carbamoyl]-6-methyl-picolinic acid Formula: C17H17BrN2O4 MolecularWeight: 393.23188

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)Br)COC)NC(=O)C2=C(N=C(C=C2)C)C(=O)O

Isomeric SMILES

CC1=C(C(=C(C=C1)Br)COC)NC(=O)C2=C(N=C(C=C2)C)C(=O)O

InChI

InChI=1S/C17H17BrN2O4/c1-9-4-7-13(18)12(8-24-3)14(9)20-16(21)11-6-5-10(2)19-15(11)17(22)23/h4-7H,8H2,1-3H3,(H,20,21)(H,22,23)