3-[2-[4-(diphenylmethyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-3H-2-benzofuran-1-one

Systemtic Name: 3-[2-[4-(diphenylmethyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-3H-2-benzofuran-1-one Openeye Name: 3-[2-(4-benzhydrylpiperazin-1-yl)-2-oxo-ethyl]-3H-isobenzofuran-1-one CAS Name: 3-[2-[4-(diphenylmethyl)-1-piperazinyl]-2-oxoethyl]-3H-isobenzofuran-1-one IUPAC Name: 3-[2-(4-benzhydrylpiperazin-1-yl)-2-oxoethyl]-3H-2-benzofuran-1-one Traditional Name: 3-[2-(4-benzhydrylpiperazino)-2-keto-ethyl]phthalide Formula: C27H26N2O3 MolecularWeight: 426.50694

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)CC4C5=CC=CC=C5C(=O)O4

Isomeric SMILES

C1CN(CCN1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)CC4C5=CC=CC=C5C(=O)O4

InChI

InChI=1S/C27H26N2O3/c30-25(19-24-22-13-7-8-14-23(22)27(31)32-24)28-15-17-29(18-16-28)26(20-9-3-1-4-10-20)21-11-5-2-6-12-21/h1-14,24,26H,15-19H2