2,3-dihydro-1,4-benzodioxin-3-yl-[4-(3,4,5-trimethoxy-2-nitro-phenyl)carbonylpiperazin-1-yl]methanone

Systemtic Name: 2,3-dihydro-1,4-benzodioxin-3-yl-[4-(3,4,5-trimethoxy-2-nitro-phenyl)carbonylpiperazin-1-yl]methanone Openeye Name: 2,3-dihydro-1,4-benzodioxin-3-yl-[4-(3,4,5-trimethoxy-2-nitro-benzoyl)piperazin-1-yl]methanone CAS Name: 2,3-dihydro-1,4-benzodioxin-3-yl-[4-[oxo-(3,4,5-trimethoxy-2-nitrophenyl)methyl]-1-piperazinyl]methanone IUPAC Name: 2,3-dihydro-1,4-benzodioxin-3-yl-[4-(3,4,5-trimethoxy-2-nitrobenzoyl)piperazin-1-yl]methanone Traditional Name: 2,3-dihydro-1,4-benzodioxin-3-yl-[4-(3,4,5-trimethoxy-2-nitro-benzoyl)piperazino]methanone Formula: C23H25N3O9 MolecularWeight: 487.4593

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C(=C1)C(=O)N2CCN(CC2)C(=O)C3COC4=CC=CC=C4O3)[N+](=O)[O-])OC)OC

Isomeric SMILES

COC1=C(C(=C(C(=C1)C(=O)N2CCN(CC2)C(=O)C3COC4=CC=CC=C4O3)[N+](=O)[O-])OC)OC

InChI

InChI=1S/C23H25N3O9/c1-31-17-12-14(19(26(29)30)21(33-3)20(17)32-2)22(27)24-8-10-25(11-9-24)23(28)18-13-34-15-6-4-5-7-16(15)35-18/h4-7,12,18H,8-11,13H2,1-3H3