7-[(E)-2-[4-(4-ethanoylpiperazin-1-yl)carbonylphenyl]ethenyl]-2,3-dihydroisoindol-1-one

Systemtic Name: 7-[(E)-2-[4-(4-ethanoylpiperazin-1-yl)carbonylphenyl]ethenyl]-2,3-dihydroisoindol-1-one Openeye Name: 7-[(E)-2-[4-(4-acetylpiperazine-1-carbonyl)phenyl]vinyl]isoindolin-1-one CAS Name: 7-[(E)-2-[4-[(4-acetyl-1-piperazinyl)-oxomethyl]phenyl]ethenyl]-2,3-dihydroisoindol-1-one IUPAC Name: 7-[(E)-2-[4-(4-acetylpiperazine-1-carbonyl)phenyl]ethenyl]-2,3-dihydroisoindol-1-one Traditional Name: 7-[(E)-2-[4-(4-acetylpiperazine-1-carbonyl)phenyl]vinyl]isoindolin-1-one Formula: C23H23N3O3 MolecularWeight: 389.44702

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C(=O)C2=CC=C(C=C2)C=CC3=C4C(=CC=C3)CNC4=O

Isomeric SMILES

CC(=O)N1CCN(CC1)C(=O)C2=CC=C(C=C2)/C=C/C3=C4C(=CC=C3)CNC4=O

InChI

InChI=1S/C23H23N3O3/c1-16(27)25-11-13-26(14-12-25)23(29)19-9-6-17(7-10-19)5-8-18-3-2-4-20-15-24-22(28)21(18)20/h2-10H,11-15H2,1H3,(H,24,28)/b8-5+