3-(4-methanethioylphenyl)-3-oxidanylidene-propanoic acid

Systemtic Name: 3-(4-methanethioylphenyl)-3-oxidanylidene-propanoic acid Openeye Name: 3-(4-methanethioylphenyl)-3-oxo-propanoic acid CAS Name: 3-(4-methanethioylphenyl)-3-oxopropanoic acid IUPAC Name: 3-(4-methanethioylphenyl)-3-oxopropanoic acid Traditional Name: 3-keto-3-(4-thioformylphenyl)propionic acid Formula: C10H8O3S MolecularWeight: 208.23372

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=S)C(=O)CC(=O)O

Isomeric SMILES

C1=CC(=CC=C1C=S)C(=O)CC(=O)O

InChI

InChI=1S/C10H8O3S/c11-9(5-10(12)13)8-3-1-7(6-14)2-4-8/h1-4,6H,5H2,(H,12,13)