(4-bromanyl-3-methyl-phenyl) 2-oxidanylidenechromene-3-carboxylate

Systemtic Name: (4-bromanyl-3-methyl-phenyl) 2-oxidanylidenechromene-3-carboxylate Openeye Name: (4-bromo-3-methyl-phenyl) 2-oxochromene-3-carboxylate CAS Name: 2-oxo-1-benzopyran-3-carboxylic acid (4-bromo-3-methylphenyl) ester IUPAC Name: (4-bromo-3-methylphenyl) 2-oxochromene-3-carboxylate Traditional Name: 2-ketochromene-3-carboxylic acid (4-bromo-3-methyl-phenyl) ester Formula: C17H11BrO4 MolecularWeight: 359.17084

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC(=O)C2=CC3=CC=CC=C3OC2=O)Br

Isomeric SMILES

CC1=C(C=CC(=C1)OC(=O)C2=CC3=CC=CC=C3OC2=O)Br

InChI

InChI=1S/C17H11BrO4/c1-10-8-12(6-7-14(10)18)21-16(19)13-9-11-4-2-3-5-15(11)22-17(13)20/h2-9H,1H3