4-[5-methyl-1,3-bis(oxidanylidene)isoindol-2-yl]-N-[3-(propanoylamino)phenyl]butanamide

Systemtic Name: 4-[5-methyl-1,3-bis(oxidanylidene)isoindol-2-yl]-N-[3-(propanoylamino)phenyl]butanamide Openeye Name: 4-(5-methyl-1,3-dioxo-isoindolin-2-yl)-N-[3-(propanoylamino)phenyl]butanamide CAS Name: 4-(5-methyl-1,3-dioxo-2-isoindolyl)-N-[3-(1-oxopropylamino)phenyl]butanamide IUPAC Name: 4-(5-methyl-1,3-dioxoisoindol-2-yl)-N-[3-(propanoylamino)phenyl]butanamide Traditional Name: 4-(1,3-diketo-5-methyl-isoindolin-2-yl)-N-(3-propionamidophenyl)butyramide Formula: C22H23N3O4 MolecularWeight: 393.43572

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC(=CC=C1)NC(=O)CCCN2C(=O)C3=C(C2=O)C=C(C=C3)C

Isomeric SMILES

CCC(=O)NC1=CC(=CC=C1)NC(=O)CCCN2C(=O)C3=C(C2=O)C=C(C=C3)C

InChI

InChI=1S/C22H23N3O4/c1-3-19(26)23-15-6-4-7-16(13-15)24-20(27)8-5-11-25-21(28)17-10-9-14(2)12-18(17)22(25)29/h4,6-7,9-10,12-13H,3,5,8,11H2,1-2H3,(H,23,26)(H,24,27)