3-[(4-tert-butylphenyl)carbonylamino]-4-[(5-chloranylpyridin-2-yl)carbamoyl]benzoic acid

Systemtic Name: 3-[(4-tert-butylphenyl)carbonylamino]-4-[(5-chloranylpyridin-2-yl)carbamoyl]benzoic acid Openeye Name: 3-[(4-tert-butylbenzoyl)amino]-4-[(5-chloro-2-pyridyl)carbamoyl]benzoic acid CAS Name: 3-[[(4-tert-butylphenyl)-oxomethyl]amino]-4-[[(5-chloro-2-pyridinyl)amino]-oxomethyl]benzoic acid IUPAC Name: 3-[(4-tert-butylbenzoyl)amino]-4-[(5-chloropyridin-2-yl)carbamoyl]benzoic acid Traditional Name: 3-[(4-tert-butylbenzoyl)amino]-4-[(5-chloro-2-pyridyl)carbamoyl]benzoic acid Formula: C24H22ClN3O4 MolecularWeight: 451.90218

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=C(C=CC(=C2)C(=O)O)C(=O)NC3=NC=C(C=C3)Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=C(C=CC(=C2)C(=O)O)C(=O)NC3=NC=C(C=C3)Cl

InChI

InChI=1S/C24H22ClN3O4/c1-24(2,3)16-7-4-14(5-8-16)21(29)27-19-12-15(23(31)32)6-10-18(19)22(30)28-20-11-9-17(25)13-26-20/h4-13H,1-3H3,(H,27,29)(H,31,32)(H,26,28,30)