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

Systemtic Name: 2-(6-nitro-3-oxidanylidene-1,4-benzoxazin-4-yl)-N-(3-pyrrolidin-1-ylquinoxalin-2-yl)ethanamide Openeye Name: 2-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)-N-(3-pyrrolidin-1-ylquinoxalin-2-yl)acetamide CAS Name: 2-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)-N-[3-(1-pyrrolidinyl)-2-quinoxalinyl]acetamide IUPAC Name: 2-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)-N-(3-pyrrolidin-1-ylquinoxalin-2-yl)acetamide Traditional Name: 2-(3-keto-6-nitro-1,4-benzoxazin-4-yl)-N-(3-pyrrolidinoquinoxalin-2-yl)acetamide Formula: C22H20N6O5 MolecularWeight: 448.4314

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NC3=CC=CC=C3N=C2NC(=O)CN4C(=O)COC5=C4C=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C2=NC3=CC=CC=C3N=C2NC(=O)CN4C(=O)COC5=C4C=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C22H20N6O5/c29-19(12-27-17-11-14(28(31)32)7-8-18(17)33-13-20(27)30)25-21-22(26-9-3-4-10-26)24-16-6-2-1-5-15(16)23-21/h1-2,5-8,11H,3-4,9-10,12-13H2,(H,23,25,29)