1-[4-[[5-(2-methoxyphenyl)-1-benzofuran-2-yl]methyl]-1,4-diazepan-1-yl]-3-phenoxy-propan-2-ol

Systemtic Name: 1-[4-[[5-(2-methoxyphenyl)-1-benzofuran-2-yl]methyl]-1,4-diazepan-1-yl]-3-phenoxy-propan-2-ol Openeye Name: 1-[4-[[5-(2-methoxyphenyl)benzofuran-2-yl]methyl]-1,4-diazepan-1-yl]-3-phenoxy-propan-2-ol CAS Name: 1-[4-[[5-(2-methoxyphenyl)-2-benzofuranyl]methyl]-1,4-diazepan-1-yl]-3-phenoxy-2-propanol IUPAC Name: 1-[4-[[5-(2-methoxyphenyl)-1-benzofuran-2-yl]methyl]-1,4-diazepan-1-yl]-3-phenoxypropan-2-ol Traditional Name: 1-[4-[[5-(2-methoxyphenyl)benzofuran-2-yl]methyl]-1,4-diazepan-1-yl]-3-phenoxy-propan-2-ol Formula: C30H34N2O4 MolecularWeight: 486.60196

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=CC3=C(C=C2)OC(=C3)CN4CCCN(CC4)CC(COC5=CC=CC=C5)O

Isomeric SMILES

COC1=CC=CC=C1C2=CC3=C(C=C2)OC(=C3)CN4CCCN(CC4)CC(COC5=CC=CC=C5)O

InChI

InChI=1S/C30H34N2O4/c1-34-30-11-6-5-10-28(30)23-12-13-29-24(18-23)19-27(36-29)21-32-15-7-14-31(16-17-32)20-25(33)22-35-26-8-3-2-4-9-26/h2-6,8-13,18-19,25,33H,7,14-17,20-22H2,1H3