1-(3-oxidanylidene-1-benzothiophen-2-yl)imidazole-2-carboxylate

Systemtic Name: 1-(3-oxidanylidene-1-benzothiophen-2-yl)imidazole-2-carboxylate Openeye Name: 1-(3-oxobenzothiophen-2-yl)imidazole-2-carboxylate CAS Name: 1-(3-oxo-1-benzothiophen-2-yl)-2-imidazolecarboxylate IUPAC Name: 1-(3-oxo-1-benzothiophen-2-yl)imidazole-2-carboxylate Traditional Name: 1-(3-ketobenzothiophen-2-yl)imidazole-2-carboxylate Formula: C12H7N2O3S- MolecularWeight: 259.26058

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C(S2)N3C=CN=C3C(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C(S2)N3C=CN=C3C(=O)[O-]

InChI

InChI=1S/C12H8N2O3S/c15-9-7-3-1-2-4-8(7)18-11(9)14-6-5-13-10(14)12(16)17/h1-6,11H,(H,16,17)/p-1