1-[2-[4-[[6-methoxy-2-(4-methoxyphenyl)-1-benzofuran-3-yl]methyl]phenoxy]ethyl]azepane

Systemtic Name: 1-[2-[4-[[6-methoxy-2-(4-methoxyphenyl)-1-benzofuran-3-yl]methyl]phenoxy]ethyl]azepane Openeye Name: 1-[2-[4-[[6-methoxy-2-(4-methoxyphenyl)benzofuran-3-yl]methyl]phenoxy]ethyl]azepane CAS Name: 1-[2-[4-[[6-methoxy-2-(4-methoxyphenyl)-3-benzofuranyl]methyl]phenoxy]ethyl]azepane IUPAC Name: 1-[2-[4-[[6-methoxy-2-(4-methoxyphenyl)-1-benzofuran-3-yl]methyl]phenoxy]ethyl]azepane Traditional Name: 1-[2-[4-[[6-methoxy-2-(4-methoxyphenyl)benzofuran-3-yl]methyl]phenoxy]ethyl]azepane Formula: C31H35NO4 MolecularWeight: 485.6139

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(C3=C(O2)C=C(C=C3)OC)CC4=CC=C(C=C4)OCCN5CCCCCC5

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(C3=C(O2)C=C(C=C3)OC)CC4=CC=C(C=C4)OCCN5CCCCCC5

InChI

InChI=1S/C31H35NO4/c1-33-25-13-9-24(10-14-25)31-29(28-16-15-27(34-2)22-30(28)36-31)21-23-7-11-26(12-8-23)35-20-19-32-17-5-3-4-6-18-32/h7-16,22H,3-6,17-21H2,1-2H3