ethyl (3E)-3-[(3-chloranyl-1-benzothiophen-2-yl)carbonylhydrazinylidene]-2-methyl-butanoate

Systemtic Name: ethyl (3E)-3-[(3-chloranyl-1-benzothiophen-2-yl)carbonylhydrazinylidene]-2-methyl-butanoate Openeye Name: ethyl (3E)-3-[(3-chlorobenzothiophene-2-carbonyl)hydrazono]-2-methyl-butanoate CAS Name: (3E)-3-[[(3-chloro-1-benzothiophen-2-yl)-oxomethyl]hydrazinylidene]-2-methylbutanoic acid ethyl ester IUPAC Name: ethyl (3E)-3-[(3-chloro-1-benzothiophene-2-carbonyl)hydrazinylidene]-2-methylbutanoate Traditional Name: (3E)-3-[(3-chlorobenzothiophene-2-carbonyl)hydrazono]-2-methyl-butyric acid ethyl ester Formula: C16H17ClN2O3S MolecularWeight: 352.83578

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)C(=NNC(=O)C1=C(C2=CC=CC=C2S1)Cl)C

Isomeric SMILES

CCOC(=O)C(C)/C(=N/NC(=O)C1=C(C2=CC=CC=C2S1)Cl)/C

InChI

InChI=1S/C16H17ClN2O3S/c1-4-22-16(21)9(2)10(3)18-19-15(20)14-13(17)11-7-5-6-8-12(11)23-14/h5-9H,4H2,1-3H3,(H,19,20)/b18-10+