bis[2-chloranyl-5-(2-ethylhexoxycarbonylamino)-4-fluoranyl-phenyl] carbonate

Systemtic Name: bis[2-chloranyl-5-(2-ethylhexoxycarbonylamino)-4-fluoranyl-phenyl] carbonate Openeye Name: bis[2-chloro-5-(2-ethylhexoxycarbonylamino)-4-fluoro-phenyl] carbonate CAS Name: carbonic acid bis[2-chloro-5-[[2-ethylhexoxy(oxo)methyl]amino]-4-fluorophenyl] ester IUPAC Name: bis[2-chloro-5-(2-ethylhexoxycarbonylamino)-4-fluorophenyl] carbonate Traditional Name: carbonic acid bis[2-chloro-5-(2-ethylhexoxycarbonylamino)-4-fluoro-phenyl] ester Formula: C31H40Cl2F2N2O7 MolecularWeight: 661.561306

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)COC(=O)NC1=CC(=C(C=C1F)Cl)OC(=O)OC2=C(C=C(C(=C2)NC(=O)OCC(CC)CCCC)F)Cl

Isomeric SMILES

CCCCC(CC)COC(=O)NC1=CC(=C(C=C1F)Cl)OC(=O)OC2=C(C=C(C(=C2)NC(=O)OCC(CC)CCCC)F)Cl

InChI

InChI=1S/C31H40Cl2F2N2O7/c1-5-9-11-19(7-3)17-41-29(38)36-25-15-27(21(32)13-23(25)34)43-31(40)44-28-16-26(24(35)14-22(28)33)37-30(39)42-18-20(8-4)12-10-6-2/h13-16,19-20H,5-12,17-18H2,1-4H3,(H,36,38)(H,37,39)