6-bromanyl-4-phenyl-1H-isochromene-3-carboxylic acid

Systemtic Name: 6-bromanyl-4-phenyl-1H-isochromene-3-carboxylic acid Openeye Name: 6-bromo-4-phenyl-1H-isochromene-3-carboxylic acid CAS Name: 6-bromo-4-phenyl-1H-2-benzopyran-3-carboxylic acid IUPAC Name: 6-bromo-4-phenyl-1H-isochromene-3-carboxylic acid Traditional Name: 6-bromo-4-phenyl-1H-isochromene-3-carboxylic acid Formula: C16H11BrO3 MolecularWeight: 331.16074

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=C(C=C2)Br)C(=C(O1)C(=O)O)C3=CC=CC=C3

Isomeric SMILES

C1C2=C(C=C(C=C2)Br)C(=C(O1)C(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C16H11BrO3/c17-12-7-6-11-9-20-15(16(18)19)14(13(11)8-12)10-4-2-1-3-5-10/h1-8H,9H2,(H,18,19)