ethyl 4-[3-[(3-oxidanylidene-2-propyl-1H-isoindol-1-yl)amino]phenyl]carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[3-[(3-oxidanylidene-2-propyl-1H-isoindol-1-yl)amino]phenyl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[3-[(3-oxo-2-propyl-isoindolin-1-yl)amino]benzoyl]piperazine-1-carboxylate CAS Name: 4-[oxo-[3-[(3-oxo-2-propyl-1H-isoindol-1-yl)amino]phenyl]methyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-[(3-oxo-2-propyl-1H-isoindol-1-yl)amino]benzoyl]piperazine-1-carboxylate Traditional Name: 4-[3-[(3-keto-2-propyl-isoindolin-1-yl)amino]benzoyl]piperazine-1-carboxylic acid ethyl ester Formula: C25H30N4O4 MolecularWeight: 450.5301

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(C2=CC=CC=C2C1=O)NC3=CC=CC(=C3)C(=O)N4CCN(CC4)C(=O)OCC

Isomeric SMILES

CCCN1C(C2=CC=CC=C2C1=O)NC3=CC=CC(=C3)C(=O)N4CCN(CC4)C(=O)OCC

InChI

InChI=1S/C25H30N4O4/c1-3-12-29-22(20-10-5-6-11-21(20)24(29)31)26-19-9-7-8-18(17-19)23(30)27-13-15-28(16-14-27)25(32)33-4-2/h5-11,17,22,26H,3-4,12-16H2,1-2H3