[3-[(Z)-1,3-dimethoxy-3-oxidanylidene-prop-1-en-2-yl]-1-benzothiophen-2-yl]methylphosphonic acid

Systemtic Name: [3-[(Z)-1,3-dimethoxy-3-oxidanylidene-prop-1-en-2-yl]-1-benzothiophen-2-yl]methylphosphonic acid Openeye Name: [3-[(Z)-2-methoxy-1-methoxycarbonyl-vinyl]benzothiophen-2-yl]methylphosphonic acid CAS Name: [3-[(Z)-1,3-dimethoxy-3-oxoprop-1-en-2-yl]-1-benzothiophen-2-yl]methylphosphonic acid IUPAC Name: [3-[(Z)-1,3-dimethoxy-3-oxoprop-1-en-2-yl]-1-benzothiophen-2-yl]methylphosphonic acid Traditional Name: [3-[(Z)-1-carbomethoxy-2-methoxy-vinyl]benzothiophen-2-yl]methylphosphonic acid Formula: C14H15O6PS MolecularWeight: 342.304061

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Descriptors Computed from Structure

Canonical SMILES:

COC=C(C1=C(SC2=CC=CC=C21)CP(=O)(O)O)C(=O)OC

Isomeric SMILES

CO/C=C(/C1=C(SC2=CC=CC=C21)CP(=O)(O)O)\C(=O)OC

InChI

InChI=1S/C14H15O6PS/c1-19-7-10(14(15)20-2)13-9-5-3-4-6-11(9)22-12(13)8-21(16,17)18/h3-7H,8H2,1-2H3,(H2,16,17,18)/b10-7-