1-[[5-(4-methylphenyl)-1-benzofuran-2-yl]methyl]-4-[(2-phenylphenyl)methyl]-1,4-diazepane

Systemtic Name: 1-[[5-(4-methylphenyl)-1-benzofuran-2-yl]methyl]-4-[(2-phenylphenyl)methyl]-1,4-diazepane Openeye Name: 1-[(2-phenylphenyl)methyl]-4-[[5-(p-tolyl)benzofuran-2-yl]methyl]-1,4-diazepane CAS Name: 1-[[5-(4-methylphenyl)-2-benzofuranyl]methyl]-4-[(2-phenylphenyl)methyl]-1,4-diazepane IUPAC Name: 1-[[5-(4-methylphenyl)-1-benzofuran-2-yl]methyl]-4-[(2-phenylphenyl)methyl]-1,4-diazepane Traditional Name: 1-(2-phenylbenzyl)-4-[[5-(p-tolyl)benzofuran-2-yl]methyl]-1,4-diazepane Formula: C34H34N2O MolecularWeight: 486.64656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC3=C(C=C2)OC(=C3)CN4CCCN(CC4)CC5=CC=CC=C5C6=CC=CC=C6

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC3=C(C=C2)OC(=C3)CN4CCCN(CC4)CC5=CC=CC=C5C6=CC=CC=C6

InChI

InChI=1S/C34H34N2O/c1-26-12-14-27(15-13-26)29-16-17-34-31(22-29)23-32(37-34)25-36-19-7-18-35(20-21-36)24-30-10-5-6-11-33(30)28-8-3-2-4-9-28/h2-6,8-17,22-23H,7,18-21,24-25H2,1H3