(2E)-2-[2-(imidazol-1-ylmethyl)-6H-1-benzothiophen-5-ylidene]ethanoic acid

Systemtic Name: (2E)-2-[2-(imidazol-1-ylmethyl)-6H-1-benzothiophen-5-ylidene]ethanoic acid Openeye Name: (2E)-2-[2-(imidazol-1-ylmethyl)-6H-benzothiophen-5-ylidene]acetic acid CAS Name: (2E)-2-[2-(1-imidazolylmethyl)-6H-1-benzothiophen-5-ylidene]acetic acid IUPAC Name: (2E)-2-[2-(imidazol-1-ylmethyl)-6H-1-benzothiophen-5-ylidene]acetic acid Traditional Name: (2E)-2-[2-(imidazol-1-ylmethyl)-6H-benzothiophen-5-ylidene]acetic acid Formula: C14H12N2O2S MolecularWeight: 272.32228

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Descriptors Computed from Structure

Canonical SMILES:

C1C=C2C(=CC1=CC(=O)O)C=C(S2)CN3C=CN=C3

Isomeric SMILES

C\1C=C2C(=C/C1=C/C(=O)O)C=C(S2)CN3C=CN=C3

InChI

InChI=1S/C14H12N2O2S/c17-14(18)6-10-1-2-13-11(5-10)7-12(19-13)8-16-4-3-15-9-16/h2-7,9H,1,8H2,(H,17,18)/b10-6+