4-[2-[bis(fluoranyl)methoxy]phenyl]-2-[(3Z)-hexa-3,5-dien-3-yl]-2,6-dimethyl-3-nitro-3,4-dihydro-1H-pyridine-5-carboxylate

Systemtic Name: 4-[2-[bis(fluoranyl)methoxy]phenyl]-2-[(3Z)-hexa-3,5-dien-3-yl]-2,6-dimethyl-3-nitro-3,4-dihydro-1H-pyridine-5-carboxylate Openeye Name: 4-[2-(difluoromethoxy)phenyl]-2-[(1Z)-1-ethylbuta-1,3-dienyl]-2,6-dimethyl-3-nitro-3,4-dihydro-1H-pyridine-5-carboxylate CAS Name: 4-[2-(difluoromethoxy)phenyl]-2-[(3Z)-hexa-3,5-dien-3-yl]-2,6-dimethyl-3-nitro-3,4-dihydro-1H-pyridine-5-carboxylate IUPAC Name: 4-[2-(difluoromethoxy)phenyl]-2-[(3Z)-hexa-3,5-dien-3-yl]-2,6-dimethyl-3-nitro-3,4-dihydro-1H-pyridine-5-carboxylate Traditional Name: 4-[2-(difluoromethoxy)phenyl]-2-[(1Z)-1-ethylbuta-1,3-dienyl]-2,6-dimethyl-3-nitro-3,4-dihydro-1H-pyridine-5-carboxylate Formula: C21H23F2N2O5- MolecularWeight: 421.414526

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=CC=C)C1(C(C(C(=C(N1)C)C(=O)[O-])C2=CC=CC=C2OC(F)F)[N+](=O)[O-])C

Isomeric SMILES

CC/C(=C/C=C)/C1(C(C(C(=C(N1)C)C(=O)[O-])C2=CC=CC=C2OC(F)F)[N+](=O)[O-])C

InChI

InChI=1S/C21H24F2N2O5/c1-5-9-13(6-2)21(4)18(25(28)29)17(16(19(26)27)12(3)24-21)14-10-7-8-11-15(14)30-20(22)23/h5,7-11,17-18,20,24H,1,6H2,2-4H3,(H,26,27)/p-1/b13-9-