(4-azanylidene-3-cyano-2-oxidanylidene-pentyl) 3-chloranyl-1-benzothiophene-2-carboxylate

Systemtic Name: (4-azanylidene-3-cyano-2-oxidanylidene-pentyl) 3-chloranyl-1-benzothiophene-2-carboxylate Openeye Name: (3-cyano-4-imino-2-oxo-pentyl) 3-chlorobenzothiophene-2-carboxylate CAS Name: 3-chloro-1-benzothiophene-2-carboxylic acid (3-cyano-4-imino-2-oxopentyl) ester IUPAC Name: (3-cyano-4-imino-2-oxopentyl) 3-chloro-1-benzothiophene-2-carboxylate Traditional Name: 3-chlorobenzothiophene-2-carboxylic acid (3-cyano-4-imino-2-keto-pentyl) ester Formula: C15H11ClN2O3S MolecularWeight: 334.77744

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)C(C#N)C(=O)COC(=O)C1=C(C2=CC=CC=C2S1)Cl

Isomeric SMILES

CC(=N)C(C#N)C(=O)COC(=O)C1=C(C2=CC=CC=C2S1)Cl

InChI

InChI=1S/C15H11ClN2O3S/c1-8(18)10(6-17)11(19)7-21-15(20)14-13(16)9-4-2-3-5-12(9)22-14/h2-5,10,18H,7H2,1H3