2-chloranyl-4-[5-[(E)-(3-oxidanylidene-1-benzothiophen-2-ylidene)methyl]furan-2-yl]benzoic acid

Systemtic Name: 2-chloranyl-4-[5-[(E)-(3-oxidanylidene-1-benzothiophen-2-ylidene)methyl]furan-2-yl]benzoic acid Openeye Name: 2-chloro-4-[5-[(E)-(3-oxobenzothiophen-2-ylidene)methyl]-2-furyl]benzoic acid CAS Name: 2-chloro-4-[5-[(E)-(3-oxo-1-benzothiophen-2-ylidene)methyl]-2-furanyl]benzoic acid IUPAC Name: 2-chloro-4-[5-[(E)-(3-oxo-1-benzothiophen-2-ylidene)methyl]furan-2-yl]benzoic acid Traditional Name: 2-chloro-4-[5-[(E)-(3-ketobenzothiophen-2-ylidene)methyl]-2-furyl]benzoic acid Formula: C20H11ClO4S MolecularWeight: 382.81694

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C(=CC3=CC=C(O3)C4=CC(=C(C=C4)C(=O)O)Cl)S2

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)/C(=C\C3=CC=C(O3)C4=CC(=C(C=C4)C(=O)O)Cl)/S2

InChI

InChI=1S/C20H11ClO4S/c21-15-9-11(5-7-13(15)20(23)24)16-8-6-12(25-16)10-18-19(22)14-3-1-2-4-17(14)26-18/h1-10H,(H,23,24)/b18-10+