cyclopropyl-[4-[[5-(2-methoxyphenyl)-1-benzofuran-2-yl]methyl]-1,4-diazepan-1-yl]methanone

Systemtic Name: cyclopropyl-[4-[[5-(2-methoxyphenyl)-1-benzofuran-2-yl]methyl]-1,4-diazepan-1-yl]methanone Openeye Name: cyclopropyl-[4-[[5-(2-methoxyphenyl)benzofuran-2-yl]methyl]-1,4-diazepan-1-yl]methanone CAS Name: cyclopropyl-[4-[[5-(2-methoxyphenyl)-2-benzofuranyl]methyl]-1,4-diazepan-1-yl]methanone IUPAC Name: cyclopropyl-[4-[[5-(2-methoxyphenyl)-1-benzofuran-2-yl]methyl]-1,4-diazepan-1-yl]methanone Traditional Name: cyclopropyl-[4-[[5-(2-methoxyphenyl)benzofuran-2-yl]methyl]-1,4-diazepan-1-yl]methanone Formula: C25H28N2O3 MolecularWeight: 404.50142

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=CC3=C(C=C2)OC(=C3)CN4CCCN(CC4)C(=O)C5CC5

Isomeric SMILES

COC1=CC=CC=C1C2=CC3=C(C=C2)OC(=C3)CN4CCCN(CC4)C(=O)C5CC5

InChI

InChI=1S/C25H28N2O3/c1-29-24-6-3-2-5-22(24)19-9-10-23-20(15-19)16-21(30-23)17-26-11-4-12-27(14-13-26)25(28)18-7-8-18/h2-3,5-6,9-10,15-16,18H,4,7-8,11-14,17H2,1H3