4,4-dimethyl-2-[3-[4-(6-methylpyridin-2-yl)piperazin-1-yl]propyl]isoquinoline-1,3-dione

Systemtic Name: 4,4-dimethyl-2-[3-[4-(6-methylpyridin-2-yl)piperazin-1-yl]propyl]isoquinoline-1,3-dione Openeye Name: 4,4-dimethyl-2-[3-[4-(6-methyl-2-pyridyl)piperazin-1-yl]propyl]isoquinoline-1,3-dione CAS Name: 4,4-dimethyl-2-[3-[4-(6-methyl-2-pyridinyl)-1-piperazinyl]propyl]isoquinoline-1,3-dione IUPAC Name: 4,4-dimethyl-2-[3-[4-(6-methylpyridin-2-yl)piperazin-1-yl]propyl]isoquinoline-1,3-dione Traditional Name: 4,4-dimethyl-2-[3-[4-(6-methyl-2-pyridyl)piperazino]propyl]isoquinoline-1,3-quinone Formula: C24H30N4O2 MolecularWeight: 406.5206

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC=C1)N2CCN(CC2)CCCN3C(=O)C4=CC=CC=C4C(C3=O)(C)C

Isomeric SMILES

CC1=NC(=CC=C1)N2CCN(CC2)CCCN3C(=O)C4=CC=CC=C4C(C3=O)(C)C

InChI

InChI=1S/C24H30N4O2/c1-18-8-6-11-21(25-18)27-16-14-26(15-17-27)12-7-13-28-22(29)19-9-4-5-10-20(19)24(2,3)23(28)30/h4-6,8-11H,7,12-17H2,1-3H3