1,6-bis[2-[(3,4-dimethoxyphenyl)methyl]pyrrolidin-1-yl]hexane-1,6-dione

Systemtic Name: 1,6-bis[2-[(3,4-dimethoxyphenyl)methyl]pyrrolidin-1-yl]hexane-1,6-dione Openeye Name: 1,6-bis[2-[(3,4-dimethoxyphenyl)methyl]pyrrolidin-1-yl]hexane-1,6-dione CAS Name: 1,6-bis[2-[(3,4-dimethoxyphenyl)methyl]-1-pyrrolidinyl]hexane-1,6-dione IUPAC Name: 1,6-bis[2-[(3,4-dimethoxyphenyl)methyl]pyrrolidin-1-yl]hexane-1,6-dione Traditional Name: 1,6-bis(2-veratrylpyrrolidino)hexane-1,6-dione Formula: C32H44N2O6 MolecularWeight: 552.70156

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC2CCCN2C(=O)CCCCC(=O)N3CCCC3CC4=CC(=C(C=C4)OC)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CC2CCCN2C(=O)CCCCC(=O)N3CCCC3CC4=CC(=C(C=C4)OC)OC)OC

InChI

InChI=1S/C32H44N2O6/c1-37-27-15-13-23(21-29(27)39-3)19-25-9-7-17-33(25)31(35)11-5-6-12-32(36)34-18-8-10-26(34)20-24-14-16-28(38-2)30(22-24)40-4/h13-16,21-22,25-26H,5-12,17-20H2,1-4H3