1,4-bis[(6,7,8-trimethoxynaphthalen-2-yl)methyl]-1,4-diazepane

Systemtic Name: 1,4-bis[(6,7,8-trimethoxynaphthalen-2-yl)methyl]-1,4-diazepane Openeye Name: 1,4-bis[(6,7,8-trimethoxy-2-naphthyl)methyl]-1,4-diazepane CAS Name: 1,4-bis[(6,7,8-trimethoxy-2-naphthalenyl)methyl]-1,4-diazepane IUPAC Name: 1,4-bis[(6,7,8-trimethoxynaphthalen-2-yl)methyl]-1,4-diazepane Traditional Name: 1,4-bis[(6,7,8-trimethoxy-2-naphthyl)methyl]-1,4-diazepane Formula: C33H40N2O6 MolecularWeight: 560.6805

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C2C=C(C=CC2=C1)CN3CCCN(CC3)CC4=CC5=C(C(=C(C=C5C=C4)OC)OC)OC)OC)OC

Isomeric SMILES

COC1=C(C(=C2C=C(C=CC2=C1)CN3CCCN(CC3)CC4=CC5=C(C(=C(C=C5C=C4)OC)OC)OC)OC)OC

InChI

InChI=1S/C33H40N2O6/c1-36-28-18-24-10-8-22(16-26(24)30(38-3)32(28)40-5)20-34-12-7-13-35(15-14-34)21-23-9-11-25-19-29(37-2)33(41-6)31(39-4)27(25)17-23/h8-11,16-19H,7,12-15,20-21H2,1-6H3