3-(1-phenyl-2-sulfanylidene-pyridin-1-ium-3-ylidene)prop-2-enoic acid

Systemtic Name: 3-(1-phenyl-2-sulfanylidene-pyridin-1-ium-3-ylidene)prop-2-enoic acid Openeye Name: 3-(1-phenyl-2-thioxo-pyridin-1-ium-3-ylidene)prop-2-enoic acid CAS Name: 3-(1-phenyl-2-sulfanylidene-3-pyridin-1-iumylidene)-2-propenoic acid IUPAC Name: 3-(1-phenyl-2-sulfanylidenepyridin-1-ium-3-ylidene)prop-2-enoic acid Traditional Name: 3-(1-phenyl-2-thioxo-pyridin-1-ium-3-ylidene)acrylic acid Formula: C14H10NO2S+ MolecularWeight: 256.2997

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[N+]2=CC=CC(=C=CC(=O)O)C2=S

Isomeric SMILES

C1=CC=C(C=C1)[N+]2=CC=CC(=C=CC(=O)O)C2=S

InChI

InChI=1S/C14H9NO2S/c16-13(17)9-8-11-5-4-10-15(14(11)18)12-6-2-1-3-7-12/h1-7,9-10H/p+1