2-[(4-bromanyl-2-methyl-phenyl)carbonylamino]-5-methyl-benzoic acid

Systemtic Name: 2-[(4-bromanyl-2-methyl-phenyl)carbonylamino]-5-methyl-benzoic acid Openeye Name: 2-[(4-bromo-2-methyl-benzoyl)amino]-5-methyl-benzoic acid CAS Name: 2-[[(4-bromo-2-methylphenyl)-oxomethyl]amino]-5-methylbenzoic acid IUPAC Name: 2-[(4-bromo-2-methylbenzoyl)amino]-5-methylbenzoic acid Traditional Name: 2-[(4-bromo-2-methyl-benzoyl)amino]-5-methyl-benzoic acid Formula: C16H14BrNO3 MolecularWeight: 348.19126

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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