O5-(2-cyanoethyl) O3-methyl 2-(4-azidobutyl)-6-methyl-4-(4-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: O5-(2-cyanoethyl) O3-methyl 2-(4-azidobutyl)-6-methyl-4-(4-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: O5-(2-cyanoethyl) O3-methyl 2-(4-azidobutyl)-6-methyl-4-(4-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2-(4-azidobutyl)-6-methyl-4-(4-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid O5-(2-cyanoethyl) ester O3-methyl ester IUPAC Name: 5-O-(2-cyanoethyl) 3-O-methyl 2-(4-azidobutyl)-6-methyl-4-(4-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 2-(4-azidobutyl)-6-methyl-4-(4-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid O5-(2-cyanoethyl) ester O3-methyl ester Formula: C22H24N6O6 MolecularWeight: 468.46256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)CCCCN=[N+]=[N-])C(=O)OC)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)OCCC#N

Isomeric SMILES

CC1=C(C(C(=C(N1)CCCCN=[N+]=[N-])C(=O)OC)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)OCCC#N

InChI

InChI=1S/C22H24N6O6/c1-14-18(22(30)34-13-5-11-23)19(15-7-9-16(10-8-15)28(31)32)20(21(29)33-2)17(26-14)6-3-4-12-25-27-24/h7-10,19,26H,3-6,12-13H2,1-2H3