3-[(6-chloranyl-4-oxidanylidene-2-phenyl-chromen-3-yl)oxymethyl]benzoic acid

Systemtic Name: 3-[(6-chloranyl-4-oxidanylidene-2-phenyl-chromen-3-yl)oxymethyl]benzoic acid Openeye Name: 3-[(6-chloro-4-oxo-2-phenyl-chromen-3-yl)oxymethyl]benzoic acid CAS Name: 3-[(6-chloro-4-oxo-2-phenyl-1-benzopyran-3-yl)oxymethyl]benzoic acid IUPAC Name: 3-[(6-chloro-4-oxo-2-phenylchromen-3-yl)oxymethyl]benzoic acid Traditional Name: 3-[(6-chloro-4-keto-2-phenyl-chromen-3-yl)oxymethyl]benzoic acid Formula: C23H15ClO5 MolecularWeight: 406.8152

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C(=O)C3=C(O2)C=CC(=C3)Cl)OCC4=CC=CC(=C4)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C(=O)C3=C(O2)C=CC(=C3)Cl)OCC4=CC=CC(=C4)C(=O)O

InChI

InChI=1S/C23H15ClO5/c24-17-9-10-19-18(12-17)20(25)22(21(29-19)15-6-2-1-3-7-15)28-13-14-5-4-8-16(11-14)23(26)27/h1-12H,13H2,(H,26,27)