5-(4-cyclopropylcarbonylpiperazin-1-yl)carbonyl-2-phenethyl-isoindole-1,3-dione

Systemtic Name: 5-(4-cyclopropylcarbonylpiperazin-1-yl)carbonyl-2-phenethyl-isoindole-1,3-dione Openeye Name: 5-[4-(cyclopropanecarbonyl)piperazine-1-carbonyl]-2-phenethyl-isoindoline-1,3-dione CAS Name: 5-[[4-[cyclopropyl(oxo)methyl]-1-piperazinyl]-oxomethyl]-2-phenethylisoindole-1,3-dione IUPAC Name: 5-[4-(cyclopropanecarbonyl)piperazine-1-carbonyl]-2-phenethylisoindole-1,3-dione Traditional Name: 5-[4-(cyclopropanecarbonyl)piperazine-1-carbonyl]-2-phenethyl-isoindoline-1,3-quinone Formula: C25H25N3O4 MolecularWeight: 431.4837

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)N2CCN(CC2)C(=O)C3=CC4=C(C=C3)C(=O)N(C4=O)CCC5=CC=CC=C5

Isomeric SMILES

C1CC1C(=O)N2CCN(CC2)C(=O)C3=CC4=C(C=C3)C(=O)N(C4=O)CCC5=CC=CC=C5

InChI

InChI=1S/C25H25N3O4/c29-22(18-6-7-18)26-12-14-27(15-13-26)23(30)19-8-9-20-21(16-19)25(32)28(24(20)31)11-10-17-4-2-1-3-5-17/h1-5,8-9,16,18H,6-7,10-15H2