6-[[5-[(4-tert-butylphenyl)carbamoyl]-2-chloranyl-phenyl]-methyl-amino]-5-chloranyl-pyridine-3-carboxylic acid

Systemtic Name: 6-[[5-[(4-tert-butylphenyl)carbamoyl]-2-chloranyl-phenyl]-methyl-amino]-5-chloranyl-pyridine-3-carboxylic acid Openeye Name: 6-[5-[(4-tert-butylphenyl)carbamoyl]-2-chloro-N-methyl-anilino]-5-chloro-pyridine-3-carboxylic acid CAS Name: 6-[5-[(4-tert-butylanilino)-oxomethyl]-2-chloro-N-methylanilino]-5-chloro-3-pyridinecarboxylic acid IUPAC Name: 6-[5-[(4-tert-butylphenyl)carbamoyl]-2-chloro-N-methylanilino]-5-chloropyridine-3-carboxylic acid Traditional Name: 6-[5-[(4-tert-butylphenyl)carbamoyl]-2-chloro-N-methyl-anilino]-5-chloro-nicotinic acid Formula: C24H23Cl2N3O3 MolecularWeight: 472.36372

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)Cl)N(C)C3=C(C=C(C=N3)C(=O)O)Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)Cl)N(C)C3=C(C=C(C=N3)C(=O)O)Cl

InChI

InChI=1S/C24H23Cl2N3O3/c1-24(2,3)16-6-8-17(9-7-16)28-22(30)14-5-10-18(25)20(12-14)29(4)21-19(26)11-15(13-27-21)23(31)32/h5-13H,1-4H3,(H,28,30)(H,31,32)