4-(4-oxidanylidenethiochromen-2-yl)benzoic acid

Systemtic Name: 4-(4-oxidanylidenethiochromen-2-yl)benzoic acid Openeye Name: 4-(4-oxothiochromen-2-yl)benzoic acid CAS Name: 4-(4-oxo-1-benzothiopyran-2-yl)benzoic acid IUPAC Name: 4-(4-oxothiochromen-2-yl)benzoic acid Traditional Name: 4-(4-ketothiochromen-2-yl)benzoic acid Formula: C16H10O3S MolecularWeight: 282.3138

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C=C(S2)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C=C(S2)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C16H10O3S/c17-13-9-15(20-14-4-2-1-3-12(13)14)10-5-7-11(8-6-10)16(18)19/h1-9H,(H,18,19)