N-(3,5-dimethylphenyl)-4-(5-fluoranyl-2-oxidanyl-phenyl)-4-methyl-2-oxidanyl-2-(phenylmethyl)pentanamide

Systemtic Name: N-(3,5-dimethylphenyl)-4-(5-fluoranyl-2-oxidanyl-phenyl)-4-methyl-2-oxidanyl-2-(phenylmethyl)pentanamide Openeye Name: 2-benzyl-N-(3,5-dimethylphenyl)-4-(5-fluoro-2-hydroxy-phenyl)-2-hydroxy-4-methyl-pentanamide CAS Name: N-(3,5-dimethylphenyl)-4-(5-fluoro-2-hydroxyphenyl)-2-hydroxy-4-methyl-2-(phenylmethyl)pentanamide IUPAC Name: 2-benzyl-N-(3,5-dimethylphenyl)-4-(5-fluoro-2-hydroxyphenyl)-2-hydroxy-4-methylpentanamide Traditional Name: 2-benzyl-N-(3,5-dimethylphenyl)-4-(5-fluoro-2-hydroxy-phenyl)-2-hydroxy-4-methyl-valeramide Formula: C27H30FNO3 MolecularWeight: 435.530403

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=O)C(CC2=CC=CC=C2)(CC(C)(C)C3=C(C=CC(=C3)F)O)O)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)C(CC2=CC=CC=C2)(CC(C)(C)C3=C(C=CC(=C3)F)O)O)C

InChI

InChI=1S/C27H30FNO3/c1-18-12-19(2)14-22(13-18)29-25(31)27(32,16-20-8-6-5-7-9-20)17-26(3,4)23-15-21(28)10-11-24(23)30/h5-15,30,32H,16-17H2,1-4H3,(H,29,31)