1-[4-(4-imidazo[4,5-b]pyridin-1-ylbutoxy)-3-methyl-2-oxidanyl-phenyl]-3-methyl-butan-1-one

Systemtic Name: 1-[4-(4-imidazo[4,5-b]pyridin-1-ylbutoxy)-3-methyl-2-oxidanyl-phenyl]-3-methyl-butan-1-one Openeye Name: 1-[2-hydroxy-4-(4-imidazo[4,5-b]pyridin-1-ylbutoxy)-3-methyl-phenyl]-3-methyl-butan-1-one CAS Name: 1-[2-hydroxy-4-[4-(1-imidazo[4,5-b]pyridinyl)butoxy]-3-methylphenyl]-3-methyl-1-butanone IUPAC Name: 1-[2-hydroxy-4-(4-imidazo[4,5-b]pyridin-1-ylbutoxy)-3-methylphenyl]-3-methylbutan-1-one Traditional Name: 1-[2-hydroxy-4-(4-imidazo[4,5-b]pyridin-1-ylbutoxy)-3-methyl-phenyl]-3-methyl-butan-1-one Formula: C22H27N3O3 MolecularWeight: 381.46808

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1O)C(=O)CC(C)C)OCCCCN2C=NC3=C2C=CC=N3

Isomeric SMILES

CC1=C(C=CC(=C1O)C(=O)CC(C)C)OCCCCN2C=NC3=C2C=CC=N3

InChI

InChI=1S/C22H27N3O3/c1-15(2)13-19(26)17-8-9-20(16(3)21(17)27)28-12-5-4-11-25-14-24-22-18(25)7-6-10-23-22/h6-10,14-15,27H,4-5,11-13H2,1-3H3