3-[[2-[2-(4-phenylpiperazin-1-yl)ethyl]phenyl]amino]-3H-2-benzofuran-1-one

Systemtic Name: 3-[[2-[2-(4-phenylpiperazin-1-yl)ethyl]phenyl]amino]-3H-2-benzofuran-1-one Openeye Name: 3-[2-[2-(4-phenylpiperazin-1-yl)ethyl]anilino]-3H-isobenzofuran-1-one CAS Name: 3-[2-[2-(4-phenyl-1-piperazinyl)ethyl]anilino]-3H-isobenzofuran-1-one IUPAC Name: 3-[2-[2-(4-phenylpiperazin-1-yl)ethyl]anilino]-3H-2-benzofuran-1-one Traditional Name: 3-[2-[2-(4-phenylpiperazino)ethyl]anilino]phthalide Formula: C26H27N3O2 MolecularWeight: 413.51148

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC2=CC=CC=C2NC3C4=CC=CC=C4C(=O)O3)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CCC2=CC=CC=C2NC3C4=CC=CC=C4C(=O)O3)C5=CC=CC=C5

InChI

InChI=1S/C26H27N3O2/c30-26-23-12-6-5-11-22(23)25(31-26)27-24-13-7-4-8-20(24)14-15-28-16-18-29(19-17-28)21-9-2-1-3-10-21/h1-13,25,27H,14-19H2