2,3,6-trimethyl-4-[7-[2-(4-methyl-1,4-diazepan-1-yl)benzimidazol-1-yl]heptoxy]phenol

Systemtic Name: 2,3,6-trimethyl-4-[7-[2-(4-methyl-1,4-diazepan-1-yl)benzimidazol-1-yl]heptoxy]phenol Openeye Name: 2,3,6-trimethyl-4-[7-[2-(4-methyl-1,4-diazepan-1-yl)benzimidazol-1-yl]heptoxy]phenol CAS Name: 2,3,6-trimethyl-4-[7-[2-(4-methyl-1,4-diazepan-1-yl)-1-benzimidazolyl]heptoxy]phenol IUPAC Name: 2,3,6-trimethyl-4-[7-[2-(4-methyl-1,4-diazepan-1-yl)benzimidazol-1-yl]heptoxy]phenol Traditional Name: 2,3,6-trimethyl-4-[7-[2-(4-methyl-1,4-diazepan-1-yl)benzimidazol-1-yl]heptoxy]phenol Formula: C29H42N4O2 MolecularWeight: 478.66938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1O)C)C)OCCCCCCCN2C3=CC=CC=C3N=C2N4CCCN(CC4)C

Isomeric SMILES

CC1=CC(=C(C(=C1O)C)C)OCCCCCCCN2C3=CC=CC=C3N=C2N4CCCN(CC4)C

InChI

InChI=1S/C29H42N4O2/c1-22-21-27(23(2)24(3)28(22)34)35-20-11-7-5-6-10-17-33-26-14-9-8-13-25(26)30-29(33)32-16-12-15-31(4)18-19-32/h8-9,13-14,21,34H,5-7,10-12,15-20H2,1-4H3