(E)-3-[3,4-bis(oxidanyl)phenyl]-2-thiophen-2-ylcarbonyl-prop-2-enenitrile

Systemtic Name: (E)-3-[3,4-bis(oxidanyl)phenyl]-2-thiophen-2-ylcarbonyl-prop-2-enenitrile Openeye Name: (E)-3-(3,4-dihydroxyphenyl)-2-(thiophene-2-carbonyl)prop-2-enenitrile CAS Name: (E)-3-(3,4-dihydroxyphenyl)-2-[oxo(thiophen-2-yl)methyl]-2-propenenitrile IUPAC Name: (E)-3-(3,4-dihydroxyphenyl)-2-(thiophene-2-carbonyl)prop-2-enenitrile Traditional Name: (E)-3-(3,4-dihydroxyphenyl)-2-(2-thenoyl)acrylonitrile Formula: C14H9NO3S MolecularWeight: 271.29116

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C(=O)C(=CC2=CC(=C(C=C2)O)O)C#N

Isomeric SMILES

C1=CSC(=C1)C(=O)/C(=C/C2=CC(=C(C=C2)O)O)/C#N

InChI

InChI=1S/C14H9NO3S/c15-8-10(14(18)13-2-1-5-19-13)6-9-3-4-11(16)12(17)7-9/h1-7,16-17H/b10-6+