N-[(3Z)-3-[1-cyano-2-(2-methoxyethylamino)-2-oxidanylidene-ethylidene]isoindol-1-yl]benzamide

Systemtic Name: N-[(3Z)-3-[1-cyano-2-(2-methoxyethylamino)-2-oxidanylidene-ethylidene]isoindol-1-yl]benzamide Openeye Name: N-[(3Z)-3-[1-cyano-2-(2-methoxyethylamino)-2-oxo-ethylidene]isoindol-1-yl]benzamide CAS Name: N-[(3Z)-3-[1-cyano-2-(2-methoxyethylamino)-2-oxoethylidene]-1-isoindolyl]benzamide IUPAC Name: N-[(3Z)-3-[1-cyano-2-(2-methoxyethylamino)-2-oxoethylidene]isoindol-1-yl]benzamide Traditional Name: N-[(3Z)-3-[1-cyano-2-keto-2-(2-methoxyethylamino)ethylidene]isoindol-1-yl]benzamide Formula: C21H18N4O3 MolecularWeight: 374.39262

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC(=O)C(=C1C2=CC=CC=C2C(=N1)NC(=O)C3=CC=CC=C3)C#N

Isomeric SMILES

COCCNC(=O)/C(=C\1/C2=CC=CC=C2C(=N1)NC(=O)C3=CC=CC=C3)/C#N

InChI

InChI=1S/C21H18N4O3/c1-28-12-11-23-21(27)17(13-22)18-15-9-5-6-10-16(15)19(24-18)25-20(26)14-7-3-2-4-8-14/h2-10H,11-12H2,1H3,(H,23,27)(H,24,25,26)/b18-17-