N-(2-cyanoethyl)-N-methyl-2-[(2R)-3-oxidanylidene-6-propanoyl-2-propan-2-yl-1,4-benzoxazin-4-yl]ethanamide

Systemtic Name: N-(2-cyanoethyl)-N-methyl-2-[(2R)-3-oxidanylidene-6-propanoyl-2-propan-2-yl-1,4-benzoxazin-4-yl]ethanamide Openeye Name: N-(2-cyanoethyl)-2-[(2R)-2-isopropyl-3-oxo-6-propanoyl-1,4-benzoxazin-4-yl]-N-methyl-acetamide CAS Name: N-(2-cyanoethyl)-N-methyl-2-[(2R)-3-oxo-6-(1-oxopropyl)-2-propan-2-yl-1,4-benzoxazin-4-yl]acetamide IUPAC Name: N-(2-cyanoethyl)-N-methyl-2-[(2R)-3-oxo-6-propanoyl-2-propan-2-yl-1,4-benzoxazin-4-yl]acetamide Traditional Name: N-(2-cyanoethyl)-2-[(2R)-2-isopropyl-3-keto-6-propionyl-1,4-benzoxazin-4-yl]-N-methyl-acetamide Formula: C20H25N3O4 MolecularWeight: 371.4302

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC2=C(C=C1)OC(C(=O)N2CC(=O)N(C)CCC#N)C(C)C

Isomeric SMILES

CCC(=O)C1=CC2=C(C=C1)O[C@@H](C(=O)N2CC(=O)N(C)CCC#N)C(C)C

InChI

InChI=1S/C20H25N3O4/c1-5-16(24)14-7-8-17-15(11-14)23(20(26)19(27-17)13(2)3)12-18(25)22(4)10-6-9-21/h7-8,11,13,19H,5-6,10,12H2,1-4H3/t19-/m1/s1