7a-methyl-2-[3-(4-phenylpiperazin-1-yl)propyl]-4,7-dihydro-3aH-isoindole-1,3-dione hydrochloride

Systemtic Name: 7a-methyl-2-[3-(4-phenylpiperazin-1-yl)propyl]-4,7-dihydro-3aH-isoindole-1,3-dione hydrochloride Openeye Name: 7a-methyl-2-[3-(4-phenylpiperazin-1-yl)propyl]-4,7-dihydro-3aH-isoindole-1,3-dione hydrochloride CAS Name: 7a-methyl-2-[3-(4-phenyl-1-piperazinyl)propyl]-4,7-dihydro-3aH-isoindole-1,3-dione hydrochloride IUPAC Name: 7a-methyl-2-[3-(4-phenylpiperazin-1-yl)propyl]-4,7-dihydro-3aH-isoindole-1,3-dione hydrochloride Traditional Name: 7a-methyl-2-[3-(4-phenylpiperazino)propyl]-4,7-dihydro-3aH-isoindole-1,3-quinone hydrochloride Formula: C22H30ClN3O2 MolecularWeight: 403.9455

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Descriptors Computed from Structure

Canonical SMILES:

CC12CC=CCC1C(=O)N(C2=O)CCCN3CCN(CC3)C4=CC=CC=C4.Cl

Isomeric SMILES

CC12CC=CCC1C(=O)N(C2=O)CCCN3CCN(CC3)C4=CC=CC=C4.Cl

InChI

InChI=1S/C22H29N3O2.ClH/c1-22-11-6-5-10-19(22)20(26)25(21(22)27)13-7-12-23-14-16-24(17-15-23)18-8-3-2-4-9-18;/h2-6,8-9,19H,7,10-17H2,1H3;1H