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

Systemtic Name: 3-[(3-bromanyl-2-methoxycarbonyl-6-methyl-phenyl)carbamoyl]-6-methyl-pyridine-2-carboxylic acid Openeye Name: 3-[(3-bromo-2-methoxycarbonyl-6-methyl-phenyl)carbamoyl]-6-methyl-pyridine-2-carboxylic acid CAS Name: 3-[(3-bromo-2-methoxycarbonyl-6-methylanilino)-oxomethyl]-6-methyl-2-pyridinecarboxylic acid IUPAC Name: 3-[(3-bromo-2-methoxycarbonyl-6-methylphenyl)carbamoyl]-6-methylpyridine-2-carboxylic acid Traditional Name: 3-[(3-bromo-2-carbomethoxy-6-methyl-phenyl)carbamoyl]-6-methyl-picolinic acid Formula: C17H15BrN2O5 MolecularWeight: 407.2154

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H15BrN2O5/c1-8-4-7-11(18)12(17(24)25-3)13(8)20-15(21)10-6-5-9(2)19-14(10)16(22)23/h4-7H,1-3H3,(H,20,21)(H,22,23)