tert-butyl 4-[3-[[4-(furan-3-yl)-2-nitro-phenyl]amino]phenyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[3-[[4-(furan-3-yl)-2-nitro-phenyl]amino]phenyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[3-[4-(3-furyl)-2-nitro-anilino]phenyl]piperazine-1-carboxylate CAS Name: 4-[3-[4-(3-furanyl)-2-nitroanilino]phenyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[3-[4-(furan-3-yl)-2-nitroanilino]phenyl]piperazine-1-carboxylate Traditional Name: 4-[3-[4-(3-furyl)-2-nitro-anilino]phenyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C25H28N4O5 MolecularWeight: 464.51362

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C2=CC(=CC=C2)NC3=C(C=C(C=C3)C4=COC=C4)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C2=CC(=CC=C2)NC3=C(C=C(C=C3)C4=COC=C4)[N+](=O)[O-]

InChI

InChI=1S/C25H28N4O5/c1-25(2,3)34-24(30)28-12-10-27(11-13-28)21-6-4-5-20(16-21)26-22-8-7-18(15-23(22)29(31)32)19-9-14-33-17-19/h4-9,14-17,26H,10-13H2,1-3H3