O3-[3-(dimethylamino)propyl] O5-methyl 2,6-dimethyl-4-(2-nitrophenyl)pyridine-3,5-dicarboxylate

Systemtic Name: O3-[3-(dimethylamino)propyl] O5-methyl 2,6-dimethyl-4-(2-nitrophenyl)pyridine-3,5-dicarboxylate Openeye Name: O3-[3-(dimethylamino)propyl] O5-methyl 2,6-dimethyl-4-(2-nitrophenyl)pyridine-3,5-dicarboxylate CAS Name: 2,6-dimethyl-4-(2-nitrophenyl)pyridine-3,5-dicarboxylic acid O3-[3-(dimethylamino)propyl] ester O5-methyl ester IUPAC Name: 3-O-[3-(dimethylamino)propyl] 5-O-methyl 2,6-dimethyl-4-(2-nitrophenyl)pyridine-3,5-dicarboxylate Traditional Name: 2,6-dimethyl-4-(2-nitrophenyl)pyridine-3,5-dicarboxylic acid O3-[3-(dimethylamino)propyl] ester O5-methyl ester Formula: C21H25N3O6 MolecularWeight: 415.4397

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25N3O6/c1-13-17(20(25)29-5)19(15-9-6-7-10-16(15)24(27)28)18(14(2)22-13)21(26)30-12-8-11-23(3)4/h6-7,9-10H,8,11-12H2,1-5H3