5-bromanyl-2-(2-propylpentanoylamino)benzoic acid

Systemtic Name: 5-bromanyl-2-(2-propylpentanoylamino)benzoic acid Openeye Name: 5-bromo-2-(2-propylpentanoylamino)benzoic acid CAS Name: 5-bromo-2-[(1-oxo-2-propylpentyl)amino]benzoic acid IUPAC Name: 5-bromo-2-(2-propylpentanoylamino)benzoic acid Traditional Name: 5-bromo-2-(2-propylpentanoylamino)benzoic acid Formula: C15H20BrNO3 MolecularWeight: 342.2282

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H20BrNO3/c1-3-5-10(6-4-2)14(18)17-13-8-7-11(16)9-12(13)15(19)20/h7-10H,3-6H2,1-2H3,(H,17,18)(H,19,20)