2-(4-cyanophenyl)-N-(4-methyl-1-oxidanylidene-2,3-benzoxazin-6-yl)-4-(4-methylphenyl)-2-oxidanyl-but-3-ynamide

Systemtic Name: 2-(4-cyanophenyl)-N-(4-methyl-1-oxidanylidene-2,3-benzoxazin-6-yl)-4-(4-methylphenyl)-2-oxidanyl-but-3-ynamide Openeye Name: 2-(4-cyanophenyl)-2-hydroxy-N-(4-methyl-1-oxo-2,3-benzoxazin-6-yl)-4-(p-tolyl)but-3-ynamide CAS Name: 2-(4-cyanophenyl)-2-hydroxy-N-(4-methyl-1-oxo-2,3-benzoxazin-6-yl)-4-(4-methylphenyl)-3-butynamide IUPAC Name: 2-(4-cyanophenyl)-2-hydroxy-N-(4-methyl-1-oxo-2,3-benzoxazin-6-yl)-4-(4-methylphenyl)but-3-ynamide Traditional Name: 2-(4-cyanophenyl)-2-hydroxy-N-(1-keto-4-methyl-2,3-benzoxazin-6-yl)-4-(p-tolyl)but-3-ynamide Formula: C27H19N3O4 MolecularWeight: 449.45746

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C#CC(C2=CC=C(C=C2)C#N)(C(=O)NC3=CC4=C(C=C3)C(=O)ON=C4C)O

Isomeric SMILES

CC1=CC=C(C=C1)C#CC(C2=CC=C(C=C2)C#N)(C(=O)NC3=CC4=C(C=C3)C(=O)ON=C4C)O

InChI

InChI=1S/C27H19N3O4/c1-17-3-5-19(6-4-17)13-14-27(33,21-9-7-20(16-28)8-10-21)26(32)29-22-11-12-23-24(15-22)18(2)30-34-25(23)31/h3-12,15,33H,1-2H3,(H,29,32)