3-[2-[4-[[5-(4-methylphenyl)-1-benzofuran-2-yl]methyl]piperazin-1-yl]ethyl]-1H-indole

Systemtic Name: 3-[2-[4-[[5-(4-methylphenyl)-1-benzofuran-2-yl]methyl]piperazin-1-yl]ethyl]-1H-indole Openeye Name: 3-[2-[4-[[5-(p-tolyl)benzofuran-2-yl]methyl]piperazin-1-yl]ethyl]-1H-indole CAS Name: 3-[2-[4-[[5-(4-methylphenyl)-2-benzofuranyl]methyl]-1-piperazinyl]ethyl]-1H-indole IUPAC Name: 3-[2-[4-[[5-(4-methylphenyl)-1-benzofuran-2-yl]methyl]piperazin-1-yl]ethyl]-1H-indole Traditional Name: 3-[2-[4-[[5-(p-tolyl)benzofuran-2-yl]methyl]piperazino]ethyl]-1H-indole Formula: C30H31N3O MolecularWeight: 449.58664

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC3=C(C=C2)OC(=C3)CN4CCN(CC4)CCC5=CNC6=CC=CC=C65

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC3=C(C=C2)OC(=C3)CN4CCN(CC4)CCC5=CNC6=CC=CC=C65

InChI

InChI=1S/C30H31N3O/c1-22-6-8-23(9-7-22)24-10-11-30-26(18-24)19-27(34-30)21-33-16-14-32(15-17-33)13-12-25-20-31-29-5-3-2-4-28(25)29/h2-11,18-20,31H,12-17,21H2,1H3