7a-methyl-2-[3-[4-(2-propan-2-yloxyphenyl)piperazin-1-yl]propyl]-4,7-dihydro-3aH-isoindole-1,3-dione

Systemtic Name: 7a-methyl-2-[3-[4-(2-propan-2-yloxyphenyl)piperazin-1-yl]propyl]-4,7-dihydro-3aH-isoindole-1,3-dione Openeye Name: 2-[3-[4-(2-isopropoxyphenyl)piperazin-1-yl]propyl]-7a-methyl-4,7-dihydro-3aH-isoindole-1,3-dione CAS Name: 7a-methyl-2-[3-[4-(2-propan-2-yloxyphenyl)-1-piperazinyl]propyl]-4,7-dihydro-3aH-isoindole-1,3-dione IUPAC Name: 7a-methyl-2-[3-[4-(2-propan-2-yloxyphenyl)piperazin-1-yl]propyl]-4,7-dihydro-3aH-isoindole-1,3-dione Traditional Name: 2-[3-[4-(2-isopropoxyphenyl)piperazino]propyl]-7a-methyl-4,7-dihydro-3aH-isoindole-1,3-quinone Formula: C25H35N3O3 MolecularWeight: 425.5637

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=CC=C1N2CCN(CC2)CCCN3C(=O)C4CC=CCC4(C3=O)C

Isomeric SMILES

CC(C)OC1=CC=CC=C1N2CCN(CC2)CCCN3C(=O)C4CC=CCC4(C3=O)C

InChI

InChI=1S/C25H35N3O3/c1-19(2)31-22-11-5-4-10-21(22)27-17-15-26(16-18-27)13-8-14-28-23(29)20-9-6-7-12-25(20,3)24(28)30/h4-7,10-11,19-20H,8-9,12-18H2,1-3H3