O5-ethyl O3-(2-phenylmethoxyethyl) 2-cyano-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: O5-ethyl O3-(2-phenylmethoxyethyl) 2-cyano-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: O3-(2-benzyloxyethyl) O5-ethyl 2-cyano-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2-cyano-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid O5-ethyl ester O3-(2-phenylmethoxyethyl) ester IUPAC Name: 5-O-ethyl 3-O-(2-phenylmethoxyethyl) 2-cyano-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 2-cyano-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid O3-(2-benzoxyethyl) ester O5-ethyl ester Formula: C26H25N3O7 MolecularWeight: 491.4926

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C(C1C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OCCOCC3=CC=CC=C3)C#N)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C(C1C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OCCOCC3=CC=CC=C3)C#N)C

InChI

InChI=1S/C26H25N3O7/c1-3-35-25(30)22-17(2)28-21(15-27)24(23(22)19-10-7-11-20(14-19)29(32)33)26(31)36-13-12-34-16-18-8-5-4-6-9-18/h4-11,14,23,28H,3,12-13,16H2,1-2H3