2,2-dimethyl-N'-(4-methyl-1-oxidanylidene-2,3-benzoxazin-6-yl)-4-[2-(4-methylphenyl)ethynyl]-4-oxidanyl-pentanediamide

Systemtic Name: 2,2-dimethyl-N'-(4-methyl-1-oxidanylidene-2,3-benzoxazin-6-yl)-4-[2-(4-methylphenyl)ethynyl]-4-oxidanyl-pentanediamide Openeye Name: 4-hydroxy-2,2-dimethyl-N'-(4-methyl-1-oxo-2,3-benzoxazin-6-yl)-4-[2-(p-tolyl)ethynyl]pentanediamide CAS Name: 4-hydroxy-2,2-dimethyl-N'-(4-methyl-1-oxo-2,3-benzoxazin-6-yl)-4-[2-(4-methylphenyl)ethynyl]pentanediamide IUPAC Name: 4-hydroxy-2,2-dimethyl-N'-(4-methyl-1-oxo-2,3-benzoxazin-6-yl)-4-[2-(4-methylphenyl)ethynyl]pentanediamide Traditional Name: 4-hydroxy-N'-(1-keto-4-methyl-2,3-benzoxazin-6-yl)-2,2-dimethyl-4-[2-(p-tolyl)ethynyl]glutaramide Formula: C25H25N3O5 MolecularWeight: 447.4831

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C#CC(CC(C)(C)C(=O)N)(C(=O)NC2=CC3=C(C=C2)C(=O)ON=C3C)O

Isomeric SMILES

CC1=CC=C(C=C1)C#CC(CC(C)(C)C(=O)N)(C(=O)NC2=CC3=C(C=C2)C(=O)ON=C3C)O

InChI

InChI=1S/C25H25N3O5/c1-15-5-7-17(8-6-15)11-12-25(32,14-24(3,4)22(26)30)23(31)27-18-9-10-19-20(13-18)16(2)28-33-21(19)29/h5-10,13,32H,14H2,1-4H3,(H2,26,30)(H,27,31)