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

Systemtic Name: O3-methyl O5-(1-oxidanylpropan-2-yl) 2-cyano-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: O5-(2-hydroxy-1-methyl-ethyl) O3-methyl 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-(1-hydroxypropan-2-yl) ester O3-methyl ester IUPAC Name: 5-O-(1-hydroxypropan-2-yl) 3-O-methyl 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 O5-(2-hydroxy-1-methyl-ethyl) ester O3-methyl ester Formula: C19H19N3O7 MolecularWeight: 401.37006

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19N3O7/c1-10(9-23)29-19(25)15-11(2)21-14(8-20)17(18(24)28-3)16(15)12-5-4-6-13(7-12)22(26)27/h4-7,10,16,21,23H,9H2,1-3H3