2-[[3-[(5-bromanylpyridin-3-yl)carbonylamino]-4-methyl-phenyl]carbonylamino]ethanoic acid

Systemtic Name: 2-[[3-[(5-bromanylpyridin-3-yl)carbonylamino]-4-methyl-phenyl]carbonylamino]ethanoic acid Openeye Name: 2-[[3-[(5-bromopyridine-3-carbonyl)amino]-4-methyl-benzoyl]amino]acetic acid CAS Name: 2-[[[3-[[(5-bromo-3-pyridinyl)-oxomethyl]amino]-4-methylphenyl]-oxomethyl]amino]acetic acid IUPAC Name: 2-[[3-[(5-bromopyridine-3-carbonyl)amino]-4-methylbenzoyl]amino]acetic acid Traditional Name: 2-[[3-[(5-bromonicotinoyl)amino]-4-methyl-benzoyl]amino]acetic acid Formula: C16H14BrN3O4 MolecularWeight: 392.20406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCC(=O)O)NC(=O)C2=CC(=CN=C2)Br

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NCC(=O)O)NC(=O)C2=CC(=CN=C2)Br

InChI

InChI=1S/C16H14BrN3O4/c1-9-2-3-10(15(23)19-8-14(21)22)5-13(9)20-16(24)11-4-12(17)7-18-6-11/h2-7H,8H2,1H3,(H,19,23)(H,20,24)(H,21,22)