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

Systemtic Name: 3-methyl-1-[3-methyl-2-oxidanyl-4-[4-(2-phenylbenzimidazol-1-yl)butoxy]phenyl]butan-1-one Openeye Name: 1-[2-hydroxy-3-methyl-4-[4-(2-phenylbenzimidazol-1-yl)butoxy]phenyl]-3-methyl-butan-1-one CAS Name: 1-[2-hydroxy-3-methyl-4-[4-(2-phenyl-1-benzimidazolyl)butoxy]phenyl]-3-methyl-1-butanone IUPAC Name: 1-[2-hydroxy-3-methyl-4-[4-(2-phenylbenzimidazol-1-yl)butoxy]phenyl]-3-methylbutan-1-one Traditional Name: 1-[2-hydroxy-3-methyl-4-[4-(2-phenylbenzimidazol-1-yl)butoxy]phenyl]-3-methyl-butan-1-one Formula: C29H32N2O3 MolecularWeight: 456.57598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1O)C(=O)CC(C)C)OCCCCN2C3=CC=CC=C3N=C2C4=CC=CC=C4

Isomeric SMILES

CC1=C(C=CC(=C1O)C(=O)CC(C)C)OCCCCN2C3=CC=CC=C3N=C2C4=CC=CC=C4

InChI

InChI=1S/C29H32N2O3/c1-20(2)19-26(32)23-15-16-27(21(3)28(23)33)34-18-10-9-17-31-25-14-8-7-13-24(25)30-29(31)22-11-5-4-6-12-22/h4-8,11-16,20,33H,9-10,17-19H2,1-3H3