methyl 3-oxidanylidene-3-(6-sulfanylidenecyclohexa-1,3-dien-1-yl)propanoate

Systemtic Name: methyl 3-oxidanylidene-3-(6-sulfanylidenecyclohexa-1,3-dien-1-yl)propanoate Openeye Name: methyl 3-oxo-3-(6-thioxocyclohexa-1,3-dien-1-yl)propanoate CAS Name: 3-oxo-3-(6-sulfanylidene-1-cyclohexa-1,3-dienyl)propanoic acid methyl ester IUPAC Name: methyl 3-oxo-3-(6-sulfanylidenecyclohexa-1,3-dien-1-yl)propanoate Traditional Name: 3-keto-3-(6-thioxocyclohexa-1,3-dien-1-yl)propionic acid methyl ester Formula: C10H10O3S MolecularWeight: 210.2496

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(=O)C1=CC=CCC1=S

Isomeric SMILES

COC(=O)CC(=O)C1=CC=CCC1=S

InChI

InChI=1S/C10H10O3S/c1-13-10(12)6-8(11)7-4-2-3-5-9(7)14/h2-4H,5-6H2,1H3