4-bromanyl-2-[ethyl-(2-methylphenyl)amino]benzoic acid

Systemtic Name: 4-bromanyl-2-[ethyl-(2-methylphenyl)amino]benzoic acid Openeye Name: 4-bromo-2-(N-ethyl-2-methyl-anilino)benzoic acid CAS Name: 4-bromo-2-(N-ethyl-2-methylanilino)benzoic acid IUPAC Name: 4-bromo-2-(N-ethyl-2-methylanilino)benzoic acid Traditional Name: 4-bromo-2-(N-ethyl-2-methyl-anilino)benzoic acid Formula: C16H16BrNO2 MolecularWeight: 334.20774

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1C)C2=C(C=CC(=C2)Br)C(=O)O

Isomeric SMILES

CCN(C1=CC=CC=C1C)C2=C(C=CC(=C2)Br)C(=O)O

InChI

InChI=1S/C16H16BrNO2/c1-3-18(14-7-5-4-6-11(14)2)15-10-12(17)8-9-13(15)16(19)20/h4-10H,3H2,1-2H3,(H,19,20)