(2E)-2-(3-azanylisoindol-1-ylidene)-N-(4-chlorophenyl)-2-cyano-ethanamide

Systemtic Name: (2E)-2-(3-azanylisoindol-1-ylidene)-N-(4-chlorophenyl)-2-cyano-ethanamide Openeye Name: (2E)-2-(3-aminoisoindol-1-ylidene)-N-(4-chlorophenyl)-2-cyano-acetamide CAS Name: (2E)-2-(3-amino-1-isoindolylidene)-N-(4-chlorophenyl)-2-cyanoacetamide IUPAC Name: (2E)-2-(3-aminoisoindol-1-ylidene)-N-(4-chlorophenyl)-2-cyanoacetamide Traditional Name: (2E)-2-(3-aminoisoindol-1-ylidene)-N-(4-chlorophenyl)-2-cyano-acetamide Formula: C17H11ClN4O MolecularWeight: 322.74844

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(C#N)C(=O)NC3=CC=C(C=C3)Cl)N=C2N

Isomeric SMILES

C1=CC=C2C(=C1)/C(=C(/C#N)\C(=O)NC3=CC=C(C=C3)Cl)/N=C2N

InChI

InChI=1S/C17H11ClN4O/c18-10-5-7-11(8-6-10)21-17(23)14(9-19)15-12-3-1-2-4-13(12)16(20)22-15/h1-8H,(H2,20,22)(H,21,23)/b15-14+