3-[4-(6-chloranyl-2-oxidanylidene-4-phenyl-chromen-7-yl)oxysulfonylphenyl]propanoic acid

Systemtic Name: 3-[4-(6-chloranyl-2-oxidanylidene-4-phenyl-chromen-7-yl)oxysulfonylphenyl]propanoic acid Openeye Name: 3-[4-(6-chloro-2-oxo-4-phenyl-chromen-7-yl)oxysulfonylphenyl]propanoic acid CAS Name: 3-[4-[(6-chloro-2-oxo-4-phenyl-1-benzopyran-7-yl)oxysulfonyl]phenyl]propanoic acid IUPAC Name: 3-[4-(6-chloro-2-oxo-4-phenylchromen-7-yl)oxysulfonylphenyl]propanoic acid Traditional Name: 3-[4-(6-chloro-2-keto-4-phenyl-chromen-7-yl)oxysulfonylphenyl]propionic acid Formula: C24H17ClO7S MolecularWeight: 484.90558

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=O)OC3=CC(=C(C=C23)Cl)OS(=O)(=O)C4=CC=C(C=C4)CCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=O)OC3=CC(=C(C=C23)Cl)OS(=O)(=O)C4=CC=C(C=C4)CCC(=O)O

InChI

InChI=1S/C24H17ClO7S/c25-20-12-19-18(16-4-2-1-3-5-16)13-24(28)31-21(19)14-22(20)32-33(29,30)17-9-6-15(7-10-17)8-11-23(26)27/h1-7,9-10,12-14H,8,11H2,(H,26,27)