2,3,6-trimethyl-4-[6-[2-(4-methyl-1,4-diazepan-1-yl)benzimidazol-1-yl]hexoxy]phenol

Systemtic Name: 2,3,6-trimethyl-4-[6-[2-(4-methyl-1,4-diazepan-1-yl)benzimidazol-1-yl]hexoxy]phenol Openeye Name: 2,3,6-trimethyl-4-[6-[2-(4-methyl-1,4-diazepan-1-yl)benzimidazol-1-yl]hexoxy]phenol CAS Name: 2,3,6-trimethyl-4-[6-[2-(4-methyl-1,4-diazepan-1-yl)-1-benzimidazolyl]hexoxy]phenol IUPAC Name: 2,3,6-trimethyl-4-[6-[2-(4-methyl-1,4-diazepan-1-yl)benzimidazol-1-yl]hexoxy]phenol Traditional Name: 2,3,6-trimethyl-4-[6-[2-(4-methyl-1,4-diazepan-1-yl)benzimidazol-1-yl]hexoxy]phenol Formula: C28H40N4O2 MolecularWeight: 464.6428

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1O)C)C)OCCCCCCN2C3=CC=CC=C3N=C2N4CCCN(CC4)C

Isomeric SMILES

CC1=CC(=C(C(=C1O)C)C)OCCCCCCN2C3=CC=CC=C3N=C2N4CCCN(CC4)C

InChI

InChI=1S/C28H40N4O2/c1-21-20-26(22(2)23(3)27(21)33)34-19-10-6-5-9-16-32-25-13-8-7-12-24(25)29-28(32)31-15-11-14-30(4)17-18-31/h7-8,12-13,20,33H,5-6,9-11,14-19H2,1-4H3