N-[3-[1-cyano-2-(3-methoxypropylamino)-2-oxidanylidene-ethylidene]isoindol-1-yl]-2-methyl-benzamide

Systemtic Name: N-[3-[1-cyano-2-(3-methoxypropylamino)-2-oxidanylidene-ethylidene]isoindol-1-yl]-2-methyl-benzamide Openeye Name: N-[3-[1-cyano-2-(3-methoxypropylamino)-2-oxo-ethylidene]isoindol-1-yl]-2-methyl-benzamide CAS Name: N-[3-[1-cyano-2-(3-methoxypropylamino)-2-oxoethylidene]-1-isoindolyl]-2-methylbenzamide IUPAC Name: N-[3-[1-cyano-2-(3-methoxypropylamino)-2-oxoethylidene]isoindol-1-yl]-2-methylbenzamide Traditional Name: N-[3-[1-cyano-2-keto-2-(3-methoxypropylamino)ethylidene]isoindol-1-yl]-2-methyl-benzamide Formula: C23H22N4O3 MolecularWeight: 402.44578

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC2=NC(=C(C#N)C(=O)NCCCOC)C3=CC=CC=C32

Isomeric SMILES

CC1=CC=CC=C1C(=O)NC2=NC(=C(C#N)C(=O)NCCCOC)C3=CC=CC=C32

InChI

InChI=1S/C23H22N4O3/c1-15-8-3-4-9-16(15)23(29)27-21-18-11-6-5-10-17(18)20(26-21)19(14-24)22(28)25-12-7-13-30-2/h3-6,8-11H,7,12-13H2,1-2H3,(H,25,28)(H,26,27,29)