3-(3,4-dimethoxyphenyl)-3-oxidanyl-3-thiophen-2-yl-propanenitrile

Systemtic Name: 3-(3,4-dimethoxyphenyl)-3-oxidanyl-3-thiophen-2-yl-propanenitrile Openeye Name: 3-(3,4-dimethoxyphenyl)-3-hydroxy-3-(2-thienyl)propanenitrile CAS Name: 3-(3,4-dimethoxyphenyl)-3-hydroxy-3-thiophen-2-ylpropanenitrile IUPAC Name: 3-(3,4-dimethoxyphenyl)-3-hydroxy-3-thiophen-2-ylpropanenitrile Traditional Name: 3-(3,4-dimethoxyphenyl)-3-hydroxy-3-(2-thienyl)propionitrile Formula: C15H15NO3S MolecularWeight: 289.3495

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(CC#N)(C2=CC=CS2)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(CC#N)(C2=CC=CS2)O)OC

InChI

InChI=1S/C15H15NO3S/c1-18-12-6-5-11(10-13(12)19-2)15(17,7-8-16)14-4-3-9-20-14/h3-6,9-10,17H,7H2,1-2H3