N-(4-ethyl-1-oxidanylidene-2,3-benzoxazin-6-yl)-4-methyl-2-oxidanyl-4-phenyl-2-(2-phenylethynyl)pentanamide

Systemtic Name: N-(4-ethyl-1-oxidanylidene-2,3-benzoxazin-6-yl)-4-methyl-2-oxidanyl-4-phenyl-2-(2-phenylethynyl)pentanamide Openeye Name: N-(4-ethyl-1-oxo-2,3-benzoxazin-6-yl)-2-hydroxy-4-methyl-4-phenyl-2-(2-phenylethynyl)pentanamide CAS Name: N-(4-ethyl-1-oxo-2,3-benzoxazin-6-yl)-2-hydroxy-4-methyl-4-phenyl-2-(2-phenylethynyl)pentanamide IUPAC Name: N-(4-ethyl-1-oxo-2,3-benzoxazin-6-yl)-2-hydroxy-4-methyl-4-phenyl-2-(2-phenylethynyl)pentanamide Traditional Name: N-(4-ethyl-1-keto-2,3-benzoxazin-6-yl)-2-hydroxy-2-neophyl-4-phenyl-but-3-ynamide Formula: C30H28N2O4 MolecularWeight: 480.55432

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NOC(=O)C2=C1C=C(C=C2)NC(=O)C(CC(C)(C)C3=CC=CC=C3)(C#CC4=CC=CC=C4)O

Isomeric SMILES

CCC1=NOC(=O)C2=C1C=C(C=C2)NC(=O)C(CC(C)(C)C3=CC=CC=C3)(C#CC4=CC=CC=C4)O

InChI

InChI=1S/C30H28N2O4/c1-4-26-25-19-23(15-16-24(25)27(33)36-32-26)31-28(34)30(35,18-17-21-11-7-5-8-12-21)20-29(2,3)22-13-9-6-10-14-22/h5-16,19,35H,4,20H2,1-3H3,(H,31,34)