1,4-bis[(4,5,6-trimethoxy-3-methyl-1-benzofuran-2-yl)methyl]-1,4-diazepane

Systemtic Name: 1,4-bis[(4,5,6-trimethoxy-3-methyl-1-benzofuran-2-yl)methyl]-1,4-diazepane Openeye Name: 1,4-bis[(4,5,6-trimethoxy-3-methyl-benzofuran-2-yl)methyl]-1,4-diazepane CAS Name: 1,4-bis[(4,5,6-trimethoxy-3-methyl-2-benzofuranyl)methyl]-1,4-diazepane IUPAC Name: 1,4-bis[(4,5,6-trimethoxy-3-methyl-1-benzofuran-2-yl)methyl]-1,4-diazepane Traditional Name: 1,4-bis[(4,5,6-trimethoxy-3-methyl-benzofuran-2-yl)methyl]-1,4-diazepane Formula: C31H40N2O8 MolecularWeight: 568.6579

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=CC(=C(C(=C12)OC)OC)OC)CN3CCCN(CC3)CC4=C(C5=C(C(=C(C=C5O4)OC)OC)OC)C

Isomeric SMILES

CC1=C(OC2=CC(=C(C(=C12)OC)OC)OC)CN3CCCN(CC3)CC4=C(C5=C(C(=C(C=C5O4)OC)OC)OC)C

InChI

InChI=1S/C31H40N2O8/c1-18-24(40-20-14-22(34-3)28(36-5)30(38-7)26(18)20)16-32-10-9-11-33(13-12-32)17-25-19(2)27-21(41-25)15-23(35-4)29(37-6)31(27)39-8/h14-15H,9-13,16-17H2,1-8H3