3-phenoxypropyl 4-[2-[bis(fluoranyl)methoxy]phenyl]-2,6-dimethyl-5-nitro-1,4-dihydropyridine-3-carboxylate

Systemtic Name: 3-phenoxypropyl 4-[2-[bis(fluoranyl)methoxy]phenyl]-2,6-dimethyl-5-nitro-1,4-dihydropyridine-3-carboxylate Openeye Name: 3-phenoxypropyl 4-[2-(difluoromethoxy)phenyl]-2,6-dimethyl-5-nitro-1,4-dihydropyridine-3-carboxylate CAS Name: 4-[2-(difluoromethoxy)phenyl]-2,6-dimethyl-5-nitro-1,4-dihydropyridine-3-carboxylic acid 3-phenoxypropyl ester IUPAC Name: 3-phenoxypropyl 4-[2-(difluoromethoxy)phenyl]-2,6-dimethyl-5-nitro-1,4-dihydropyridine-3-carboxylate Traditional Name: 4-[2-(difluoromethoxy)phenyl]-2,6-dimethyl-5-nitro-1,4-dihydropyridine-3-carboxylic acid 3-phenoxypropyl ester Formula: C24H24F2N2O6 MolecularWeight: 474.453966

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)[N+](=O)[O-])C2=CC=CC=C2OC(F)F)C(=O)OCCCOC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(C(=C(N1)C)[N+](=O)[O-])C2=CC=CC=C2OC(F)F)C(=O)OCCCOC3=CC=CC=C3

InChI

InChI=1S/C24H24F2N2O6/c1-15-20(23(29)33-14-8-13-32-17-9-4-3-5-10-17)21(22(28(30)31)16(2)27-15)18-11-6-7-12-19(18)34-24(25)26/h3-7,9-12,21,24,27H,8,13-14H2,1-2H3