2-[5-(1H-pyridin-4-ylidene)-6-sulfanylidene-cyclohexa-1,3-dien-1-yl]oxypropanoic acid

Systemtic Name: 2-[5-(1H-pyridin-4-ylidene)-6-sulfanylidene-cyclohexa-1,3-dien-1-yl]oxypropanoic acid Openeye Name: 2-[5-(1H-pyridin-4-ylidene)-6-thioxo-cyclohexa-1,3-dien-1-yl]oxypropanoic acid CAS Name: 2-[[5-(1H-pyridin-4-ylidene)-6-sulfanylidene-1-cyclohexa-1,3-dienyl]oxy]propanoic acid IUPAC Name: 2-[5-(1H-pyridin-4-ylidene)-6-sulfanylidenecyclohexa-1,3-dien-1-yl]oxypropanoic acid Traditional Name: 2-[5-(1H-pyridin-4-ylidene)-6-thioxo-cyclohexa-1,3-dien-1-yl]oxypropionic acid Formula: C14H13NO3S MolecularWeight: 275.32292

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)OC1=CC=CC(=C2C=CNC=C2)C1=S

Isomeric SMILES

CC(C(=O)O)OC1=CC=CC(=C2C=CNC=C2)C1=S

InChI

InChI=1S/C14H13NO3S/c1-9(14(16)17)18-12-4-2-3-11(13(12)19)10-5-7-15-8-6-10/h2-9,15H,1H3,(H,16,17)