5-bromanyl-3-methyl-2-(propylamino)benzoic acid

Systemtic Name: 5-bromanyl-3-methyl-2-(propylamino)benzoic acid Openeye Name: 5-bromo-3-methyl-2-(propylamino)benzoic acid CAS Name: 5-bromo-3-methyl-2-(propylamino)benzoic acid IUPAC Name: 5-bromo-3-methyl-2-(propylamino)benzoic acid Traditional Name: 5-bromo-3-methyl-2-(propylamino)benzoic acid Formula: C11H14BrNO2 MolecularWeight: 272.13836

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=C(C=C(C=C1C(=O)O)Br)C

Isomeric SMILES

CCCNC1=C(C=C(C=C1C(=O)O)Br)C

InChI

InChI=1S/C11H14BrNO2/c1-3-4-13-10-7(2)5-8(12)6-9(10)11(14)15/h5-6,13H,3-4H2,1-2H3,(H,14,15)