2-[(2-bromanyl-4-methyl-phenyl)amino]pentanoic acid

Systemtic Name: 2-[(2-bromanyl-4-methyl-phenyl)amino]pentanoic acid Openeye Name: 2-(2-bromo-4-methyl-anilino)pentanoic acid CAS Name: 2-(2-bromo-4-methylanilino)pentanoic acid IUPAC Name: 2-(2-bromo-4-methylanilino)pentanoic acid Traditional Name: 2-(2-bromo-4-methyl-anilino)valeric acid Formula: C12H16BrNO2 MolecularWeight: 286.16494

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)O)NC1=C(C=C(C=C1)C)Br

Isomeric SMILES

CCCC(C(=O)O)NC1=C(C=C(C=C1)C)Br

InChI

InChI=1S/C12H16BrNO2/c1-3-4-11(12(15)16)14-10-6-5-8(2)7-9(10)13/h5-7,11,14H,3-4H2,1-2H3,(H,15,16)