O3-methyl O5-propyl 4-(2-chloranyl-5-nitro-phenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: O3-methyl O5-propyl 4-(2-chloranyl-5-nitro-phenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: O3-methyl O5-propyl 4-(2-chloro-5-nitro-phenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 4-(2-chloro-5-nitrophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid O3-methyl ester O5-propyl ester IUPAC Name: 3-O-methyl 5-O-propyl 4-(2-chloro-5-nitrophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 4-(2-chloro-5-nitro-phenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid O3-methyl ester O5-propyl ester Formula: C19H21ClN2O6 MolecularWeight: 408.83284

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=C(NC(=C(C1C2=C(C=CC(=C2)[N+](=O)[O-])Cl)C(=O)OC)C)C

Isomeric SMILES

CCCOC(=O)C1=C(NC(=C(C1C2=C(C=CC(=C2)[N+](=O)[O-])Cl)C(=O)OC)C)C

InChI

InChI=1S/C19H21ClN2O6/c1-5-8-28-19(24)16-11(3)21-10(2)15(18(23)27-4)17(16)13-9-12(22(25)26)6-7-14(13)20/h6-7,9,17,21H,5,8H2,1-4H3