3-[(4-bromanyl-2-methyl-phenyl)carbonylamino]-4-methyl-benzoic acid

Systemtic Name: 3-[(4-bromanyl-2-methyl-phenyl)carbonylamino]-4-methyl-benzoic acid Openeye Name: 3-[(4-bromo-2-methyl-benzoyl)amino]-4-methyl-benzoic acid CAS Name: 3-[[(4-bromo-2-methylphenyl)-oxomethyl]amino]-4-methylbenzoic acid IUPAC Name: 3-[(4-bromo-2-methylbenzoyl)amino]-4-methylbenzoic acid Traditional Name: 3-[(4-bromo-2-methyl-benzoyl)amino]-4-methyl-benzoic acid Formula: C16H14BrNO3 MolecularWeight: 348.19126

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14BrNO3/c1-9-3-4-11(16(20)21)8-14(9)18-15(19)13-6-5-12(17)7-10(13)2/h3-8H,1-2H3,(H,18,19)(H,20,21)