3-[5-methyl-1,3-bis(oxidanylidene)isoindol-2-yl]-N-[4-(prop-2-enylcarbamoylamino)phenyl]propanamide

Systemtic Name: 3-[5-methyl-1,3-bis(oxidanylidene)isoindol-2-yl]-N-[4-(prop-2-enylcarbamoylamino)phenyl]propanamide Openeye Name: N-[4-(allylcarbamoylamino)phenyl]-3-(5-methyl-1,3-dioxo-isoindolin-2-yl)propanamide CAS Name: 3-(5-methyl-1,3-dioxo-2-isoindolyl)-N-[4-[[oxo-(prop-2-enylamino)methyl]amino]phenyl]propanamide IUPAC Name: 3-(5-methyl-1,3-dioxoisoindol-2-yl)-N-[4-(prop-2-enylcarbamoylamino)phenyl]propanamide Traditional Name: N-[4-(allylcarbamoylamino)phenyl]-3-(1,3-diketo-5-methyl-isoindolin-2-yl)propionamide Formula: C22H22N4O4 MolecularWeight: 406.43448

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=O)N(C2=O)CCC(=O)NC3=CC=C(C=C3)NC(=O)NCC=C

Isomeric SMILES

CC1=CC2=C(C=C1)C(=O)N(C2=O)CCC(=O)NC3=CC=C(C=C3)NC(=O)NCC=C

InChI

InChI=1S/C22H22N4O4/c1-3-11-23-22(30)25-16-7-5-15(6-8-16)24-19(27)10-12-26-20(28)17-9-4-14(2)13-18(17)21(26)29/h3-9,13H,1,10-12H2,2H3,(H,24,27)(H2,23,25,30)