O3-(2-cyanoethyl) O5-(phenylmethyl) 1,2-dimethyl-4-(4-nitrophenyl)-4H-pyridine-3,5-dicarboxylate

Systemtic Name: O3-(2-cyanoethyl) O5-(phenylmethyl) 1,2-dimethyl-4-(4-nitrophenyl)-4H-pyridine-3,5-dicarboxylate Openeye Name: O5-benzyl O3-(2-cyanoethyl) 1,2-dimethyl-4-(4-nitrophenyl)-4H-pyridine-3,5-dicarboxylate CAS Name: 1,2-dimethyl-4-(4-nitrophenyl)-4H-pyridine-3,5-dicarboxylic acid O3-(2-cyanoethyl) ester O5-(phenylmethyl) ester IUPAC Name: 5-O-benzyl 3-O-(2-cyanoethyl) 1,2-dimethyl-4-(4-nitrophenyl)-4H-pyridine-3,5-dicarboxylate Traditional Name: 1,2-dimethyl-4-(4-nitrophenyl)-4H-pyridine-3,5-dicarboxylic acid O5-benzyl ester O3-(2-cyanoethyl) ester Formula: C25H23N3O6 MolecularWeight: 461.46662

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=CN1C)C(=O)OCC2=CC=CC=C2)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)OCCC#N

Isomeric SMILES

CC1=C(C(C(=CN1C)C(=O)OCC2=CC=CC=C2)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)OCCC#N

InChI

InChI=1S/C25H23N3O6/c1-17-22(25(30)33-14-6-13-26)23(19-9-11-20(12-10-19)28(31)32)21(15-27(17)2)24(29)34-16-18-7-4-3-5-8-18/h3-5,7-12,15,23H,6,14,16H2,1-2H3