3-nitro-4-[4-(2-oxidanylidene-4H-3,1-benzoxazin-1-yl)piperidin-1-yl]-N-pentan-2-yl-benzamide

Systemtic Name: 3-nitro-4-[4-(2-oxidanylidene-4H-3,1-benzoxazin-1-yl)piperidin-1-yl]-N-pentan-2-yl-benzamide Openeye Name: N-(1-methylbutyl)-3-nitro-4-[4-(2-oxo-4H-3,1-benzoxazin-1-yl)-1-piperidyl]benzamide CAS Name: 3-nitro-4-[4-(2-oxo-4H-3,1-benzoxazin-1-yl)-1-piperidinyl]-N-pentan-2-ylbenzamide IUPAC Name: 3-nitro-4-[4-(2-oxo-4H-3,1-benzoxazin-1-yl)piperidin-1-yl]-N-pentan-2-ylbenzamide Traditional Name: 4-[4-(2-keto-4H-3,1-benzoxazin-1-yl)piperidino]-N-(1-methylbutyl)-3-nitro-benzamide Formula: C25H30N4O5 MolecularWeight: 466.5295

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)NC(=O)C1=CC(=C(C=C1)N2CCC(CC2)N3C4=CC=CC=C4COC3=O)[N+](=O)[O-]

Isomeric SMILES

CCCC(C)NC(=O)C1=CC(=C(C=C1)N2CCC(CC2)N3C4=CC=CC=C4COC3=O)[N+](=O)[O-]

InChI

InChI=1S/C25H30N4O5/c1-3-6-17(2)26-24(30)18-9-10-22(23(15-18)29(32)33)27-13-11-20(12-14-27)28-21-8-5-4-7-19(21)16-34-25(28)31/h4-5,7-10,15,17,20H,3,6,11-14,16H2,1-2H3,(H,26,30)