diethyl 2-(3-fluoranyl-3-phenyl-propyl)-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: diethyl 2-(3-fluoranyl-3-phenyl-propyl)-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: diethyl 2-(3-fluoro-3-phenyl-propyl)-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2-(3-fluoro-3-phenylpropyl)-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid diethyl ester IUPAC Name: diethyl 2-(3-fluoro-3-phenylpropyl)-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 2-(3-fluoro-3-phenyl-propyl)-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid diethyl ester Formula: C27H29FN2O6 MolecularWeight: 496.527363

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C(C1C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OCC)CCC(C3=CC=CC=C3)F)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C(C1C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OCC)CCC(C3=CC=CC=C3)F)C

InChI

InChI=1S/C27H29FN2O6/c1-4-35-26(31)23-17(3)29-22(15-14-21(28)18-10-7-6-8-11-18)25(27(32)36-5-2)24(23)19-12-9-13-20(16-19)30(33)34/h6-13,16,21,24,29H,4-5,14-15H2,1-3H3