N-[(3Z)-3-[1-cyano-2-(2-methylpropylamino)-2-oxidanylidene-ethylidene]isoindol-1-yl]-3,4,5-trimethoxy-benzamide

Systemtic Name: N-[(3Z)-3-[1-cyano-2-(2-methylpropylamino)-2-oxidanylidene-ethylidene]isoindol-1-yl]-3,4,5-trimethoxy-benzamide Openeye Name: N-[(3Z)-3-[1-cyano-2-(isobutylamino)-2-oxo-ethylidene]isoindol-1-yl]-3,4,5-trimethoxy-benzamide CAS Name: N-[(3Z)-3-[1-cyano-2-(2-methylpropylamino)-2-oxoethylidene]-1-isoindolyl]-3,4,5-trimethoxybenzamide IUPAC Name: N-[(3Z)-3-[1-cyano-2-(2-methylpropylamino)-2-oxoethylidene]isoindol-1-yl]-3,4,5-trimethoxybenzamide Traditional Name: N-[(3Z)-3-[1-cyano-2-(isobutylamino)-2-keto-ethylidene]isoindol-1-yl]-3,4,5-trimethoxy-benzamide Formula: C25H26N4O5 MolecularWeight: 462.49774

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H26N4O5/c1-14(2)13-27-25(31)18(12-26)21-16-8-6-7-9-17(16)23(28-21)29-24(30)15-10-19(32-3)22(34-5)20(11-15)33-4/h6-11,14H,13H2,1-5H3,(H,27,31)(H,28,29,30)/b21-18-