1-[4-[4-(benzimidazol-1-yl)butoxy]-3-methyl-2-oxidanyl-phenyl]-3-methyl-butan-1-one

Systemtic Name: 1-[4-[4-(benzimidazol-1-yl)butoxy]-3-methyl-2-oxidanyl-phenyl]-3-methyl-butan-1-one Openeye Name: 1-[4-[4-(benzimidazol-1-yl)butoxy]-2-hydroxy-3-methyl-phenyl]-3-methyl-butan-1-one CAS Name: 1-[4-[4-(1-benzimidazolyl)butoxy]-2-hydroxy-3-methylphenyl]-3-methyl-1-butanone IUPAC Name: 1-[4-[4-(benzimidazol-1-yl)butoxy]-2-hydroxy-3-methylphenyl]-3-methylbutan-1-one Traditional Name: 1-[4-[4-(benzimidazol-1-yl)butoxy]-2-hydroxy-3-methyl-phenyl]-3-methyl-butan-1-one Formula: C23H28N2O3 MolecularWeight: 380.48002

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1O)C(=O)CC(C)C)OCCCCN2C=NC3=CC=CC=C32

Isomeric SMILES

CC1=C(C=CC(=C1O)C(=O)CC(C)C)OCCCCN2C=NC3=CC=CC=C32

InChI

InChI=1S/C23H28N2O3/c1-16(2)14-21(26)18-10-11-22(17(3)23(18)27)28-13-7-6-12-25-15-24-19-8-4-5-9-20(19)25/h4-5,8-11,15-16,27H,6-7,12-14H2,1-3H3