propan-2-yl 4-[4-[[(5-nitrofuran-2-yl)carbonylamino]methyl]phenyl]piperazine-1-carboxylate

Systemtic Name: propan-2-yl 4-[4-[[(5-nitrofuran-2-yl)carbonylamino]methyl]phenyl]piperazine-1-carboxylate Openeye Name: isopropyl 4-[4-[[(5-nitrofuran-2-carbonyl)amino]methyl]phenyl]piperazine-1-carboxylate CAS Name: 4-[4-[[[(5-nitro-2-furanyl)-oxomethyl]amino]methyl]phenyl]-1-piperazinecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[4-[[(5-nitrofuran-2-carbonyl)amino]methyl]phenyl]piperazine-1-carboxylate Traditional Name: 4-[4-[[(5-nitro-2-furoyl)amino]methyl]phenyl]piperazine-1-carboxylic acid isopropyl ester Formula: C20H24N4O6 MolecularWeight: 416.42776

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)N1CCN(CC1)C2=CC=C(C=C2)CNC(=O)C3=CC=C(O3)[N+](=O)[O-]

Isomeric SMILES

CC(C)OC(=O)N1CCN(CC1)C2=CC=C(C=C2)CNC(=O)C3=CC=C(O3)[N+](=O)[O-]

InChI

InChI=1S/C20H24N4O6/c1-14(2)29-20(26)23-11-9-22(10-12-23)16-5-3-15(4-6-16)13-21-19(25)17-7-8-18(30-17)24(27)28/h3-8,14H,9-13H2,1-2H3,(H,21,25)