2-(6-nitro-3-oxidanylidene-1,4-benzoxazin-4-yl)-N-(2-pyrrolidin-1-ylbutyl)ethanamide

Systemtic Name: 2-(6-nitro-3-oxidanylidene-1,4-benzoxazin-4-yl)-N-(2-pyrrolidin-1-ylbutyl)ethanamide Openeye Name: 2-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)-N-(2-pyrrolidin-1-ylbutyl)acetamide CAS Name: 2-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)-N-[2-(1-pyrrolidinyl)butyl]acetamide IUPAC Name: 2-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)-N-(2-pyrrolidin-1-ylbutyl)acetamide Traditional Name: 2-(3-keto-6-nitro-1,4-benzoxazin-4-yl)-N-(2-pyrrolidinobutyl)acetamide Formula: C18H24N4O5 MolecularWeight: 376.40696

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CNC(=O)CN1C(=O)COC2=C1C=C(C=C2)[N+](=O)[O-])N3CCCC3

Isomeric SMILES

CCC(CNC(=O)CN1C(=O)COC2=C1C=C(C=C2)[N+](=O)[O-])N3CCCC3

InChI

InChI=1S/C18H24N4O5/c1-2-13(20-7-3-4-8-20)10-19-17(23)11-21-15-9-14(22(25)26)5-6-16(15)27-12-18(21)24/h5-6,9,13H,2-4,7-8,10-12H2,1H3,(H,19,23)