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

Systemtic Name: 3-[(3-bromanyl-6-ethyl-2-methoxycarbonyl-phenyl)carbamoyl]-6-methyl-pyridine-2-carboxylic acid Openeye Name: 3-[(3-bromo-6-ethyl-2-methoxycarbonyl-phenyl)carbamoyl]-6-methyl-pyridine-2-carboxylic acid CAS Name: 3-[(3-bromo-6-ethyl-2-methoxycarbonylanilino)-oxomethyl]-6-methyl-2-pyridinecarboxylic acid IUPAC Name: 3-[(3-bromo-6-ethyl-2-methoxycarbonylphenyl)carbamoyl]-6-methylpyridine-2-carboxylic acid Traditional Name: 3-[(3-bromo-2-carbomethoxy-6-ethyl-phenyl)carbamoyl]-6-methyl-picolinic acid Formula: C18H17BrN2O5 MolecularWeight: 421.24198

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(C=C1)Br)C(=O)OC)NC(=O)C2=C(N=C(C=C2)C)C(=O)O

Isomeric SMILES

CCC1=C(C(=C(C=C1)Br)C(=O)OC)NC(=O)C2=C(N=C(C=C2)C)C(=O)O

InChI

InChI=1S/C18H17BrN2O5/c1-4-10-6-8-12(19)13(18(25)26-3)14(10)21-16(22)11-7-5-9(2)20-15(11)17(23)24/h5-8H,4H2,1-3H3,(H,21,22)(H,23,24)