O3-(2-methoxyethyl) O5-propan-2-yl 4-(2-chloranyl-5-nitro-phenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: O3-(2-methoxyethyl) O5-propan-2-yl 4-(2-chloranyl-5-nitro-phenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: O5-isopropyl O3-(2-methoxyethyl) 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-(2-methoxyethyl) ester O5-propan-2-yl ester IUPAC Name: 3-O-(2-methoxyethyl) 5-O-propan-2-yl 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 O5-isopropyl ester O3-(2-methoxyethyl) ester Formula: C21H25ClN2O7 MolecularWeight: 452.8854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)C(=O)OC(C)C)C2=C(C=CC(=C2)[N+](=O)[O-])Cl)C(=O)OCCOC

Isomeric SMILES

CC1=C(C(C(=C(N1)C)C(=O)OC(C)C)C2=C(C=CC(=C2)[N+](=O)[O-])Cl)C(=O)OCCOC

InChI

InChI=1S/C21H25ClN2O7/c1-11(2)31-21(26)18-13(4)23-12(3)17(20(25)30-9-8-29-5)19(18)15-10-14(24(27)28)6-7-16(15)22/h6-7,10-11,19,23H,8-9H2,1-5H3