[(E)-1-thiophen-2-ylethylideneamino] 3-iodanyl-4-methyl-benzoate

Systemtic Name: [(E)-1-thiophen-2-ylethylideneamino] 3-iodanyl-4-methyl-benzoate Openeye Name: [(E)-1-(2-thienyl)ethylideneamino] 3-iodo-4-methyl-benzoate CAS Name: 3-iodo-4-methylbenzoic acid [(E)-1-thiophen-2-ylethylideneamino] ester IUPAC Name: [(E)-1-thiophen-2-ylethylideneamino] 3-iodo-4-methylbenzoate Traditional Name: 3-iodo-4-methyl-benzoic acid [(E)-1-(2-thienyl)ethylideneamino] ester Formula: C14H12INO2S MolecularWeight: 385.22005

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)ON=C(C)C2=CC=CS2)I

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)O/N=C(\C)/C2=CC=CS2)I

InChI

InChI=1S/C14H12INO2S/c1-9-5-6-11(8-12(9)15)14(17)18-16-10(2)13-4-3-7-19-13/h3-8H,1-2H3/b16-10+