5-methyl-2-[4-oxidanylidene-4-[4-(pyridin-4-ylmethyl)piperazin-1-yl]butyl]isoindole-1,3-dione

Systemtic Name: 5-methyl-2-[4-oxidanylidene-4-[4-(pyridin-4-ylmethyl)piperazin-1-yl]butyl]isoindole-1,3-dione Openeye Name: 5-methyl-2-[4-oxo-4-[4-(4-pyridylmethyl)piperazin-1-yl]butyl]isoindoline-1,3-dione CAS Name: 5-methyl-2-[4-oxo-4-[4-(pyridin-4-ylmethyl)-1-piperazinyl]butyl]isoindole-1,3-dione IUPAC Name: 5-methyl-2-[4-oxo-4-[4-(pyridin-4-ylmethyl)piperazin-1-yl]butyl]isoindole-1,3-dione Traditional Name: 2-[4-keto-4-[4-(4-pyridylmethyl)piperazino]butyl]-5-methyl-isoindoline-1,3-quinone Formula: C23H26N4O3 MolecularWeight: 406.47754

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=O)N(C2=O)CCCC(=O)N3CCN(CC3)CC4=CC=NC=C4

Isomeric SMILES

CC1=CC2=C(C=C1)C(=O)N(C2=O)CCCC(=O)N3CCN(CC3)CC4=CC=NC=C4

InChI

InChI=1S/C23H26N4O3/c1-17-4-5-19-20(15-17)23(30)27(22(19)29)10-2-3-21(28)26-13-11-25(12-14-26)16-18-6-8-24-9-7-18/h4-9,15H,2-3,10-14,16H2,1H3