(E)-2-cyano-3-[3-ethoxy-4-(thiophen-2-ylmethoxy)phenyl]prop-2-enoic acid

Systemtic Name: (E)-2-cyano-3-[3-ethoxy-4-(thiophen-2-ylmethoxy)phenyl]prop-2-enoic acid Openeye Name: (E)-2-cyano-3-[3-ethoxy-4-(2-thienylmethoxy)phenyl]prop-2-enoic acid CAS Name: (E)-2-cyano-3-[3-ethoxy-4-(thiophen-2-ylmethoxy)phenyl]-2-propenoic acid IUPAC Name: (E)-2-cyano-3-[3-ethoxy-4-(thiophen-2-ylmethoxy)phenyl]prop-2-enoic acid Traditional Name: (E)-2-cyano-3-[3-ethoxy-4-(2-thenyloxy)phenyl]acrylic acid Formula: C17H15NO4S MolecularWeight: 329.3703

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=C(C#N)C(=O)O)OCC2=CC=CS2

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=C(\C#N)/C(=O)O)OCC2=CC=CS2

InChI

InChI=1S/C17H15NO4S/c1-2-21-16-9-12(8-13(10-18)17(19)20)5-6-15(16)22-11-14-4-3-7-23-14/h3-9H,2,11H2,1H3,(H,19,20)/b13-8+