5-bromanyl-2-[4-(4-cyclopropylcarbonylpiperazin-1-yl)-4-oxidanylidene-butyl]isoindole-1,3-dione

Systemtic Name: 5-bromanyl-2-[4-(4-cyclopropylcarbonylpiperazin-1-yl)-4-oxidanylidene-butyl]isoindole-1,3-dione Openeye Name: 5-bromo-2-[4-[4-(cyclopropanecarbonyl)piperazin-1-yl]-4-oxo-butyl]isoindoline-1,3-dione CAS Name: 5-bromo-2-[4-[4-[cyclopropyl(oxo)methyl]-1-piperazinyl]-4-oxobutyl]isoindole-1,3-dione IUPAC Name: 5-bromo-2-[4-[4-(cyclopropanecarbonyl)piperazin-1-yl]-4-oxobutyl]isoindole-1,3-dione Traditional Name: 5-bromo-2-[4-[4-(cyclopropanecarbonyl)piperazino]-4-keto-butyl]isoindoline-1,3-quinone Formula: C20H22BrN3O4 MolecularWeight: 448.31038

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)N2CCN(CC2)C(=O)CCCN3C(=O)C4=C(C3=O)C=C(C=C4)Br

Isomeric SMILES

C1CC1C(=O)N2CCN(CC2)C(=O)CCCN3C(=O)C4=C(C3=O)C=C(C=C4)Br

InChI

InChI=1S/C20H22BrN3O4/c21-14-5-6-15-16(12-14)20(28)24(19(15)27)7-1-2-17(25)22-8-10-23(11-9-22)18(26)13-3-4-13/h5-6,12-13H,1-4,7-11H2