(4,5-dimethoxy-2-nitro-phenyl)methyl [2-methoxy-4-[(nonanoylamino)methyl]phenyl] carbonate

Systemtic Name: (4,5-dimethoxy-2-nitro-phenyl)methyl [2-methoxy-4-[(nonanoylamino)methyl]phenyl] carbonate Openeye Name: (4,5-dimethoxy-2-nitro-phenyl)methyl [2-methoxy-4-[(nonanoylamino)methyl]phenyl] carbonate CAS Name: carbonic acid (4,5-dimethoxy-2-nitrophenyl)methyl [2-methoxy-4-[(1-oxononylamino)methyl]phenyl] ester IUPAC Name: (4,5-dimethoxy-2-nitrophenyl)methyl [2-methoxy-4-[(nonanoylamino)methyl]phenyl] carbonate Traditional Name: carbonic acid (4,5-dimethoxy-2-nitro-benzyl) [2-methoxy-4-[(pelargonylamino)methyl]phenyl] ester Formula: C27H36N2O9 MolecularWeight: 532.58274

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(=O)NCC1=CC(=C(C=C1)OC(=O)OCC2=CC(=C(C=C2[N+](=O)[O-])OC)OC)OC

Isomeric SMILES

CCCCCCCCC(=O)NCC1=CC(=C(C=C1)OC(=O)OCC2=CC(=C(C=C2[N+](=O)[O-])OC)OC)OC

InChI

InChI=1S/C27H36N2O9/c1-5-6-7-8-9-10-11-26(30)28-17-19-12-13-22(23(14-19)34-2)38-27(31)37-18-20-15-24(35-3)25(36-4)16-21(20)29(32)33/h12-16H,5-11,17-18H2,1-4H3,(H,28,30)