N-(2-cyanoethyl)-4-(6-ethanoyl-3-oxidanylidene-1,4-benzoxazin-4-yl)-N-(pyridin-3-ylmethyl)butanamide

Systemtic Name: N-(2-cyanoethyl)-4-(6-ethanoyl-3-oxidanylidene-1,4-benzoxazin-4-yl)-N-(pyridin-3-ylmethyl)butanamide Openeye Name: 4-(6-acetyl-3-oxo-1,4-benzoxazin-4-yl)-N-(2-cyanoethyl)-N-(3-pyridylmethyl)butanamide CAS Name: 4-(6-acetyl-3-oxo-1,4-benzoxazin-4-yl)-N-(2-cyanoethyl)-N-(3-pyridinylmethyl)butanamide IUPAC Name: 4-(6-acetyl-3-oxo-1,4-benzoxazin-4-yl)-N-(2-cyanoethyl)-N-(pyridin-3-ylmethyl)butanamide Traditional Name: 4-(6-acetyl-3-keto-1,4-benzoxazin-4-yl)-N-(2-cyanoethyl)-N-(3-pyridylmethyl)butyramide Formula: C23H24N4O4 MolecularWeight: 420.46106

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1)OCC(=O)N2CCCC(=O)N(CCC#N)CC3=CN=CC=C3

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1)OCC(=O)N2CCCC(=O)N(CCC#N)CC3=CN=CC=C3

InChI

InChI=1S/C23H24N4O4/c1-17(28)19-7-8-21-20(13-19)27(23(30)16-31-21)12-3-6-22(29)26(11-4-9-24)15-18-5-2-10-25-14-18/h2,5,7-8,10,13-14H,3-4,6,11-12,15-16H2,1H3