5-ethoxy-6-phenylmethoxy-1-benzothiophene-2-carboxylic acid

Systemtic Name: 5-ethoxy-6-phenylmethoxy-1-benzothiophene-2-carboxylic acid Openeye Name: 6-benzyloxy-5-ethoxy-benzothiophene-2-carboxylic acid CAS Name: 5-ethoxy-6-phenylmethoxy-1-benzothiophene-2-carboxylic acid IUPAC Name: 5-ethoxy-6-phenylmethoxy-1-benzothiophene-2-carboxylic acid Traditional Name: 6-benzoxy-5-ethoxy-benzothiophene-2-carboxylic acid Formula: C18H16O4S MolecularWeight: 328.38224

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)C=C(S2)C(=O)O)OCC3=CC=CC=C3

Isomeric SMILES

CCOC1=C(C=C2C(=C1)C=C(S2)C(=O)O)OCC3=CC=CC=C3

InChI

InChI=1S/C18H16O4S/c1-2-21-14-8-13-9-17(18(19)20)23-16(13)10-15(14)22-11-12-6-4-3-5-7-12/h3-10H,2,11H2,1H3,(H,19,20)