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

Systemtic Name: 3-[[2-[2-[4-(4-methoxyphenyl)piperazin-1-yl]ethyl]phenyl]amino]-3H-2-benzofuran-1-one Openeye Name: 3-[2-[2-[4-(4-methoxyphenyl)piperazin-1-yl]ethyl]anilino]-3H-isobenzofuran-1-one CAS Name: 3-[2-[2-[4-(4-methoxyphenyl)-1-piperazinyl]ethyl]anilino]-3H-isobenzofuran-1-one IUPAC Name: 3-[2-[2-[4-(4-methoxyphenyl)piperazin-1-yl]ethyl]anilino]-3H-2-benzofuran-1-one Traditional Name: 3-[2-[2-[4-(4-methoxyphenyl)piperazino]ethyl]anilino]phthalide Formula: C27H29N3O3 MolecularWeight: 443.53746

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)CCC3=CC=CC=C3NC4C5=CC=CC=C5C(=O)O4

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)CCC3=CC=CC=C3NC4C5=CC=CC=C5C(=O)O4

InChI

InChI=1S/C27H29N3O3/c1-32-22-12-10-21(11-13-22)30-18-16-29(17-19-30)15-14-20-6-2-5-9-25(20)28-26-23-7-3-4-8-24(23)27(31)33-26/h2-13,26,28H,14-19H2,1H3