4-[4-[(5-methoxy-2-methyl-3-phenyl-1-benzofuran-6-yl)methyl]piperazin-1-yl]-2-(oxolan-2-ylmethyl)isoindole-1,3-dione

Systemtic Name: 4-[4-[(5-methoxy-2-methyl-3-phenyl-1-benzofuran-6-yl)methyl]piperazin-1-yl]-2-(oxolan-2-ylmethyl)isoindole-1,3-dione Openeye Name: 4-[4-[(5-methoxy-2-methyl-3-phenyl-benzofuran-6-yl)methyl]piperazin-1-yl]-2-(tetrahydrofuran-2-ylmethyl)isoindoline-1,3-dione CAS Name: 4-[4-[(5-methoxy-2-methyl-3-phenyl-6-benzofuranyl)methyl]-1-piperazinyl]-2-(2-oxolanylmethyl)isoindole-1,3-dione IUPAC Name: 4-[4-[(5-methoxy-2-methyl-3-phenyl-1-benzofuran-6-yl)methyl]piperazin-1-yl]-2-(oxolan-2-ylmethyl)isoindole-1,3-dione Traditional Name: 4-[4-[(5-methoxy-2-methyl-3-phenyl-benzofuran-6-yl)methyl]piperazino]-2-(tetrahydrofurfuryl)isoindoline-1,3-quinone Formula: C34H35N3O5 MolecularWeight: 565.6588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC(=C(C=C2O1)CN3CCN(CC3)C4=CC=CC5=C4C(=O)N(C5=O)CC6CCCO6)OC)C7=CC=CC=C7

Isomeric SMILES

CC1=C(C2=CC(=C(C=C2O1)CN3CCN(CC3)C4=CC=CC5=C4C(=O)N(C5=O)CC6CCCO6)OC)C7=CC=CC=C7

InChI

InChI=1S/C34H35N3O5/c1-22-31(23-8-4-3-5-9-23)27-19-29(40-2)24(18-30(27)42-22)20-35-13-15-36(16-14-35)28-12-6-11-26-32(28)34(39)37(33(26)38)21-25-10-7-17-41-25/h3-6,8-9,11-12,18-19,25H,7,10,13-17,20-21H2,1-2H3