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

Systemtic Name: 2-(6-nitro-3-oxidanylidene-1,4-benzoxazin-4-yl)-N-(3-pyrrolidin-1-ylcarbonylphenyl)ethanamide Openeye Name: 2-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)-N-[3-(pyrrolidine-1-carbonyl)phenyl]acetamide CAS Name: 2-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)-N-[3-[oxo(1-pyrrolidinyl)methyl]phenyl]acetamide IUPAC Name: 2-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)-N-[3-(pyrrolidine-1-carbonyl)phenyl]acetamide Traditional Name: 2-(3-keto-6-nitro-1,4-benzoxazin-4-yl)-N-[3-(pyrrolidine-1-carbonyl)phenyl]acetamide Formula: C21H20N4O6 MolecularWeight: 424.4067

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=CC(=CC=C2)NC(=O)CN3C(=O)COC4=C3C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C(=O)C2=CC(=CC=C2)NC(=O)CN3C(=O)COC4=C3C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H20N4O6/c26-19(22-15-5-3-4-14(10-15)21(28)23-8-1-2-9-23)12-24-17-11-16(25(29)30)6-7-18(17)31-13-20(24)27/h3-7,10-11H,1-2,8-9,12-13H2,(H,22,26)