(6-chloranyl-7-methyl-4-oxidanylidene-2-phenyl-chromen-3-yl) 4-bromanylbenzoate

Systemtic Name: (6-chloranyl-7-methyl-4-oxidanylidene-2-phenyl-chromen-3-yl) 4-bromanylbenzoate Openeye Name: (6-chloro-7-methyl-4-oxo-2-phenyl-chromen-3-yl) 4-bromobenzoate CAS Name: 4-bromobenzoic acid (6-chloro-7-methyl-4-oxo-2-phenyl-1-benzopyran-3-yl) ester IUPAC Name: (6-chloro-7-methyl-4-oxo-2-phenylchromen-3-yl) 4-bromobenzoate Traditional Name: 4-bromobenzoic acid (6-chloro-4-keto-7-methyl-2-phenyl-chromen-3-yl) ester Formula: C23H14BrClO4 MolecularWeight: 469.71186

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)OC(=C(C2=O)OC(=O)C3=CC=C(C=C3)Br)C4=CC=CC=C4)Cl

Isomeric SMILES

CC1=C(C=C2C(=C1)OC(=C(C2=O)OC(=O)C3=CC=C(C=C3)Br)C4=CC=CC=C4)Cl

InChI

InChI=1S/C23H14BrClO4/c1-13-11-19-17(12-18(13)25)20(26)22(21(28-19)14-5-3-2-4-6-14)29-23(27)15-7-9-16(24)10-8-15/h2-12H,1H3