3-[2-(3-cyanophenyl)-1-oxidanylidene-3H-isoindol-5-yl]-N-cyclopropyl-4-methyl-benzamide

Systemtic Name: 3-[2-(3-cyanophenyl)-1-oxidanylidene-3H-isoindol-5-yl]-N-cyclopropyl-4-methyl-benzamide Openeye Name: 3-[2-(3-cyanophenyl)-1-oxo-isoindolin-5-yl]-N-cyclopropyl-4-methyl-benzamide CAS Name: 3-[2-(3-cyanophenyl)-1-oxo-3H-isoindol-5-yl]-N-cyclopropyl-4-methylbenzamide IUPAC Name: 3-[2-(3-cyanophenyl)-1-oxo-3H-isoindol-5-yl]-N-cyclopropyl-4-methylbenzamide Traditional Name: 3-[2-(3-cyanophenyl)-1-keto-isoindolin-5-yl]-N-cyclopropyl-4-methyl-benzamide Formula: C26H21N3O2 MolecularWeight: 407.46384

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2CC2)C3=CC4=C(C=C3)C(=O)N(C4)C5=CC=CC(=C5)C#N

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2CC2)C3=CC4=C(C=C3)C(=O)N(C4)C5=CC=CC(=C5)C#N

InChI

InChI=1S/C26H21N3O2/c1-16-5-6-19(25(30)28-21-8-9-21)13-24(16)18-7-10-23-20(12-18)15-29(26(23)31)22-4-2-3-17(11-22)14-27/h2-7,10-13,21H,8-9,15H2,1H3,(H,28,30)