[2,6-dimethyl-4-(3-nitrophenyl)-5-propan-2-yloxycarbonyloxy-1,4-dihydropyridin-3-yl] 9,9,9-tris(fluoranyl)nonyl carbonate

Systemtic Name: [2,6-dimethyl-4-(3-nitrophenyl)-5-propan-2-yloxycarbonyloxy-1,4-dihydropyridin-3-yl] 9,9,9-tris(fluoranyl)nonyl carbonate Openeye Name: [2,6-dimethyl-4-(3-nitrophenyl)-5-(9,9,9-trifluorononoxycarbonyloxy)-1,4-dihydropyridin-3-yl] isopropyl carbonate CAS Name: carbonic acid [2,6-dimethyl-4-(3-nitrophenyl)-5-[oxo(propan-2-yloxy)methoxy]-1,4-dihydropyridin-3-yl] 9,9,9-trifluorononyl ester IUPAC Name: [2,6-dimethyl-4-(3-nitrophenyl)-5-propan-2-yloxycarbonyloxy-1,4-dihydropyridin-3-yl] 9,9,9-trifluorononyl carbonate Traditional Name: carbonic acid [2,6-dimethyl-4-(3-nitrophenyl)-5-(9,9,9-trifluorononoxycarbonyloxy)-1,4-dihydropyridin-3-yl] isopropyl ester Formula: C27H35F3N2O8 MolecularWeight: 572.57061

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)OC(=O)OC(C)C)C2=CC(=CC=C2)[N+](=O)[O-])OC(=O)OCCCCCCCCC(F)(F)F

Isomeric SMILES

CC1=C(C(C(=C(N1)C)OC(=O)OC(C)C)C2=CC(=CC=C2)[N+](=O)[O-])OC(=O)OCCCCCCCCC(F)(F)F

InChI

InChI=1S/C27H35F3N2O8/c1-17(2)38-26(34)40-24-19(4)31-18(3)23(22(24)20-12-11-13-21(16-20)32(35)36)39-25(33)37-15-10-8-6-5-7-9-14-27(28,29)30/h11-13,16-17,22,31H,5-10,14-15H2,1-4H3