2-cyano-4-methoxy-3-(thiophen-3-ylmethyl)benzoic acid

Systemtic Name: 2-cyano-4-methoxy-3-(thiophen-3-ylmethyl)benzoic acid Openeye Name: 2-cyano-4-methoxy-3-(3-thienylmethyl)benzoic acid CAS Name: 2-cyano-4-methoxy-3-(3-thiophenylmethyl)benzoic acid IUPAC Name: 2-cyano-4-methoxy-3-(thiophen-3-ylmethyl)benzoic acid Traditional Name: 2-cyano-4-methoxy-3-(3-thenyl)benzoic acid Formula: C14H11NO3S MolecularWeight: 273.30704

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)C(=O)O)C#N)CC2=CSC=C2

Isomeric SMILES

COC1=C(C(=C(C=C1)C(=O)O)C#N)CC2=CSC=C2

InChI

InChI=1S/C14H11NO3S/c1-18-13-3-2-10(14(16)17)12(7-15)11(13)6-9-4-5-19-8-9/h2-5,8H,6H2,1H3,(H,16,17)