3-[4-(diphenylmethyl)piperazin-1-yl]-6,7-dimethoxy-3H-2-benzofuran-1-one

Systemtic Name: 3-[4-(diphenylmethyl)piperazin-1-yl]-6,7-dimethoxy-3H-2-benzofuran-1-one Openeye Name: 3-(4-benzhydrylpiperazin-1-yl)-6,7-dimethoxy-3H-isobenzofuran-1-one CAS Name: 3-[4-(diphenylmethyl)-1-piperazinyl]-6,7-dimethoxy-3H-isobenzofuran-1-one IUPAC Name: 3-(4-benzhydrylpiperazin-1-yl)-6,7-dimethoxy-3H-2-benzofuran-1-one Traditional Name: 3-(4-benzhydrylpiperazino)-6,7-dimethoxy-phthalide Formula: C27H28N2O4 MolecularWeight: 444.52222

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C1)C(OC2=O)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5)OC

Isomeric SMILES

COC1=C(C2=C(C=C1)C(OC2=O)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5)OC

InChI

InChI=1S/C27H28N2O4/c1-31-22-14-13-21-23(25(22)32-2)27(30)33-26(21)29-17-15-28(16-18-29)24(19-9-5-3-6-10-19)20-11-7-4-8-12-20/h3-14,24,26H,15-18H2,1-2H3