4-[(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)carbonylamino]benzoic acid

Systemtic Name: 4-[(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)carbonylamino]benzoic acid Openeye Name: 4-[(6-bromo-2,3-dihydro-1,4-benzodioxine-7-carbonyl)amino]benzoic acid CAS Name: 4-[[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-oxomethyl]amino]benzoic acid IUPAC Name: 4-[(6-bromo-2,3-dihydro-1,4-benzodioxine-7-carbonyl)amino]benzoic acid Traditional Name: 4-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-carbonyl)amino]benzoic acid Formula: C16H12BrNO5 MolecularWeight: 378.17418

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=C(C(=C2)Br)C(=O)NC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

C1COC2=C(O1)C=C(C(=C2)Br)C(=O)NC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C16H12BrNO5/c17-12-8-14-13(22-5-6-23-14)7-11(12)15(19)18-10-3-1-9(2-4-10)16(20)21/h1-4,7-8H,5-6H2,(H,18,19)(H,20,21)