N-(1-cyano-2-phenylmethoxy-ethyl)-4,4-dimethyl-2-[(2-oxidanylidene-1,3-benzoxazin-4-yl)amino]pentanamide

Systemtic Name: N-(1-cyano-2-phenylmethoxy-ethyl)-4,4-dimethyl-2-[(2-oxidanylidene-1,3-benzoxazin-4-yl)amino]pentanamide Openeye Name: N-(2-benzyloxy-1-cyano-ethyl)-4,4-dimethyl-2-[(2-oxo-1,3-benzoxazin-4-yl)amino]pentanamide CAS Name: N-(1-cyano-2-phenylmethoxyethyl)-4,4-dimethyl-2-[(2-oxo-1,3-benzoxazin-4-yl)amino]pentanamide IUPAC Name: N-(1-cyano-2-phenylmethoxyethyl)-4,4-dimethyl-2-[(2-oxo-1,3-benzoxazin-4-yl)amino]pentanamide Traditional Name: N-(2-benzoxy-1-cyano-ethyl)-2-[(2-keto-1,3-benzoxazin-4-yl)amino]-4,4-dimethyl-valeramide Formula: C25H28N4O4 MolecularWeight: 448.51422

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(C(=O)NC(COCC1=CC=CC=C1)C#N)NC2=NC(=O)OC3=CC=CC=C32

Isomeric SMILES

CC(C)(C)CC(C(=O)NC(COCC1=CC=CC=C1)C#N)NC2=NC(=O)OC3=CC=CC=C32

InChI

InChI=1S/C25H28N4O4/c1-25(2,3)13-20(28-22-19-11-7-8-12-21(19)33-24(31)29-22)23(30)27-18(14-26)16-32-15-17-9-5-4-6-10-17/h4-12,18,20H,13,15-16H2,1-3H3,(H,27,30)(H,28,29,31)