6-bromanyl-3-(3,5-dimethylphenyl)sulfonyl-chromen-2-one

Systemtic Name: 6-bromanyl-3-(3,5-dimethylphenyl)sulfonyl-chromen-2-one Openeye Name: 6-bromo-3-(3,5-dimethylphenyl)sulfonyl-chromen-2-one CAS Name: 6-bromo-3-(3,5-dimethylphenyl)sulfonyl-1-benzopyran-2-one IUPAC Name: 6-bromo-3-(3,5-dimethylphenyl)sulfonylchromen-2-one Traditional Name: 6-bromo-3-(3,5-dimethylphenyl)sulfonyl-coumarin Formula: C17H13BrO4S MolecularWeight: 393.25172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)S(=O)(=O)C2=CC3=C(C=CC(=C3)Br)OC2=O)C

Isomeric SMILES

CC1=CC(=CC(=C1)S(=O)(=O)C2=CC3=C(C=CC(=C3)Br)OC2=O)C

InChI

InChI=1S/C17H13BrO4S/c1-10-5-11(2)7-14(6-10)23(20,21)16-9-12-8-13(18)3-4-15(12)22-17(16)19/h3-9H,1-2H3