5-(3-cyano-4-propoxy-phenyl)thiophene-2-carboxylic acid

Systemtic Name: 5-(3-cyano-4-propoxy-phenyl)thiophene-2-carboxylic acid Openeye Name: 5-(3-cyano-4-propoxy-phenyl)thiophene-2-carboxylic acid CAS Name: 5-(3-cyano-4-propoxyphenyl)-2-thiophenecarboxylic acid IUPAC Name: 5-(3-cyano-4-propoxyphenyl)thiophene-2-carboxylic acid Traditional Name: 5-(3-cyano-4-propoxy-phenyl)-2-thenoic acid Formula: C15H13NO3S MolecularWeight: 287.33362

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C2=CC=C(S2)C(=O)O)C#N

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C2=CC=C(S2)C(=O)O)C#N

InChI

InChI=1S/C15H13NO3S/c1-2-7-19-12-4-3-10(8-11(12)9-16)13-5-6-14(20-13)15(17)18/h3-6,8H,2,7H2,1H3,(H,17,18)