4-[4-[3-(5,6-dimethylbenzimidazol-1-yl)-2-oxidanyl-propoxy]phenyl]butan-2-one

Systemtic Name: 4-[4-[3-(5,6-dimethylbenzimidazol-1-yl)-2-oxidanyl-propoxy]phenyl]butan-2-one Openeye Name: 4-[4-[3-(5,6-dimethylbenzimidazol-1-yl)-2-hydroxy-propoxy]phenyl]butan-2-one CAS Name: 4-[4-[3-(5,6-dimethyl-1-benzimidazolyl)-2-hydroxypropoxy]phenyl]-2-butanone IUPAC Name: 4-[4-[3-(5,6-dimethylbenzimidazol-1-yl)-2-hydroxypropoxy]phenyl]butan-2-one Traditional Name: 4-[4-[3-(5,6-dimethylbenzimidazol-1-yl)-2-hydroxy-propoxy]phenyl]butan-2-one Formula: C22H26N2O3 MolecularWeight: 366.45344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N(C=N2)CC(COC3=CC=C(C=C3)CCC(=O)C)O

Isomeric SMILES

CC1=CC2=C(C=C1C)N(C=N2)CC(COC3=CC=C(C=C3)CCC(=O)C)O

InChI

InChI=1S/C22H26N2O3/c1-15-10-21-22(11-16(15)2)24(14-23-21)12-19(26)13-27-20-8-6-18(7-9-20)5-4-17(3)25/h6-11,14,19,26H,4-5,12-13H2,1-3H3