2-(6-butanoyl-3-oxidanylidene-1,4-benzoxazin-4-yl)-N-(2-cyanoethyl)-N-methyl-ethanamide

Systemtic Name: 2-(6-butanoyl-3-oxidanylidene-1,4-benzoxazin-4-yl)-N-(2-cyanoethyl)-N-methyl-ethanamide Openeye Name: 2-(6-butanoyl-3-oxo-1,4-benzoxazin-4-yl)-N-(2-cyanoethyl)-N-methyl-acetamide CAS Name: N-(2-cyanoethyl)-N-methyl-2-[3-oxo-6-(1-oxobutyl)-1,4-benzoxazin-4-yl]acetamide IUPAC Name: 2-(6-butanoyl-3-oxo-1,4-benzoxazin-4-yl)-N-(2-cyanoethyl)-N-methylacetamide Traditional Name: 2-(6-butyryl-3-keto-1,4-benzoxazin-4-yl)-N-(2-cyanoethyl)-N-methyl-acetamide Formula: C18H21N3O4 MolecularWeight: 343.37704

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=CC2=C(C=C1)OCC(=O)N2CC(=O)N(C)CCC#N

Isomeric SMILES

CCCC(=O)C1=CC2=C(C=C1)OCC(=O)N2CC(=O)N(C)CCC#N

InChI

InChI=1S/C18H21N3O4/c1-3-5-15(22)13-6-7-16-14(10-13)21(18(24)12-25-16)11-17(23)20(2)9-4-8-19/h6-7,10H,3-5,9,11-12H2,1-2H3