4-[4-[(4-ethylphenyl)methyl]piperazin-1-yl]-2-(3-methoxypropyl)isoindole-1,3-dione

Systemtic Name: 4-[4-[(4-ethylphenyl)methyl]piperazin-1-yl]-2-(3-methoxypropyl)isoindole-1,3-dione Openeye Name: 4-[4-[(4-ethylphenyl)methyl]piperazin-1-yl]-2-(3-methoxypropyl)isoindoline-1,3-dione CAS Name: 4-[4-[(4-ethylphenyl)methyl]-1-piperazinyl]-2-(3-methoxypropyl)isoindole-1,3-dione IUPAC Name: 4-[4-[(4-ethylphenyl)methyl]piperazin-1-yl]-2-(3-methoxypropyl)isoindole-1,3-dione Traditional Name: 4-[4-(4-ethylbenzyl)piperazino]-2-(3-methoxypropyl)isoindoline-1,3-quinone Formula: C25H31N3O3 MolecularWeight: 421.53194

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CN2CCN(CC2)C3=CC=CC4=C3C(=O)N(C4=O)CCCOC

Isomeric SMILES

CCC1=CC=C(C=C1)CN2CCN(CC2)C3=CC=CC4=C3C(=O)N(C4=O)CCCOC

InChI

InChI=1S/C25H31N3O3/c1-3-19-8-10-20(11-9-19)18-26-13-15-27(16-14-26)22-7-4-6-21-23(22)25(30)28(24(21)29)12-5-17-31-2/h4,6-11H,3,5,12-18H2,1-2H3