4-(6-bromanylhexanoylamino)benzoic acid

Systemtic Name: 4-(6-bromanylhexanoylamino)benzoic acid Openeye Name: 4-(6-bromohexanoylamino)benzoic acid CAS Name: 4-[(6-bromo-1-oxohexyl)amino]benzoic acid IUPAC Name: 4-(6-bromohexanoylamino)benzoic acid Traditional Name: 4-(6-bromohexanoylamino)benzoic acid Formula: C13H16BrNO3 MolecularWeight: 314.17504

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)O)NC(=O)CCCCCBr

Isomeric SMILES

C1=CC(=CC=C1C(=O)O)NC(=O)CCCCCBr

InChI

InChI=1S/C13H16BrNO3/c14-9-3-1-2-4-12(16)15-11-7-5-10(6-8-11)13(17)18/h5-8H,1-4,9H2,(H,15,16)(H,17,18)