O3-cyclopentyl O5-methyl 2-(fluoranylmethyl)-6-methyl-4-(2-methyl-3-nitro-phenyl)-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: O3-cyclopentyl O5-methyl 2-(fluoranylmethyl)-6-methyl-4-(2-methyl-3-nitro-phenyl)-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: O3-cyclopentyl O5-methyl 2-(fluoromethyl)-6-methyl-4-(2-methyl-3-nitro-phenyl)-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2-(fluoromethyl)-6-methyl-4-(2-methyl-3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid O3-cyclopentyl ester O5-methyl ester IUPAC Name: 3-O-cyclopentyl 5-O-methyl 2-(fluoromethyl)-6-methyl-4-(2-methyl-3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 2-(fluoromethyl)-6-methyl-4-(2-methyl-3-nitro-phenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid O3-cyclopentyl ester O5-methyl ester Formula: C22H25FN2O6 MolecularWeight: 432.442103

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])C2C(=C(NC(=C2C(=O)OC3CCCC3)CF)C)C(=O)OC

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])C2C(=C(NC(=C2C(=O)OC3CCCC3)CF)C)C(=O)OC

InChI

InChI=1S/C22H25FN2O6/c1-12-15(9-6-10-17(12)25(28)29)19-18(21(26)30-3)13(2)24-16(11-23)20(19)22(27)31-14-7-4-5-8-14/h6,9-10,14,19,24H,4-5,7-8,11H2,1-3H3