7-methoxy-3-oxidanylidene-1,5-benzoxathiepine-4-carbonitrile

Systemtic Name: 7-methoxy-3-oxidanylidene-1,5-benzoxathiepine-4-carbonitrile Openeye Name: 7-methoxy-3-oxo-1,5-benzoxathiepine-4-carbonitrile CAS Name: 7-methoxy-3-oxo-1,5-benzoxathiepin-4-carbonitrile IUPAC Name: 7-methoxy-3-oxo-1,5-benzoxathiepine-4-carbonitrile Traditional Name: 3-keto-7-methoxy-1,5-benzoxathiepin-4-carbonitrile Formula: C11H9NO3S MolecularWeight: 235.25906

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)OCC(=O)C(S2)C#N

Isomeric SMILES

COC1=CC2=C(C=C1)OCC(=O)C(S2)C#N

InChI

InChI=1S/C11H9NO3S/c1-14-7-2-3-9-10(4-7)16-11(5-12)8(13)6-15-9/h2-4,11H,6H2,1H3