[4-(4-ethanoylpiperazin-1-yl)phenyl] 2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethanoate

Systemtic Name: [4-(4-ethanoylpiperazin-1-yl)phenyl] 2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethanoate Openeye Name: [4-(4-acetylpiperazin-1-yl)phenyl] 2-(1,3-dioxoisoindolin-2-yl)acetate CAS Name: 2-(1,3-dioxo-2-isoindolyl)acetic acid [4-(4-acetyl-1-piperazinyl)phenyl] ester IUPAC Name: [4-(4-acetylpiperazin-1-yl)phenyl] 2-(1,3-dioxoisoindol-2-yl)acetate Traditional Name: 2-phthalimidoacetic acid [4-(4-acetylpiperazino)phenyl] ester Formula: C22H21N3O5 MolecularWeight: 407.41924

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C2=CC=C(C=C2)OC(=O)CN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CC(=O)N1CCN(CC1)C2=CC=C(C=C2)OC(=O)CN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C22H21N3O5/c1-15(26)23-10-12-24(13-11-23)16-6-8-17(9-7-16)30-20(27)14-25-21(28)18-4-2-3-5-19(18)22(25)29/h2-9H,10-14H2,1H3