O5-[(E)-3-(4-hydroxyphenyl)but-2-enyl] O3-methyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: O5-[(E)-3-(4-hydroxyphenyl)but-2-enyl] O3-methyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: O5-[(E)-3-(4-hydroxyphenyl)but-2-enyl] O3-methyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid O5-[(E)-3-(4-hydroxyphenyl)but-2-enyl] ester O3-methyl ester IUPAC Name: 5-O-[(E)-3-(4-hydroxyphenyl)but-2-enyl] 3-O-methyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid O5-[(E)-3-(4-hydroxyphenyl)but-2-enyl] ester O3-methyl ester Formula: C26H26N2O7 MolecularWeight: 478.49384

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)C(=O)OCC=C(C)C2=CC=C(C=C2)O)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC1=C(C(C(=C(N1)C)C(=O)OC/C=C(\C)/C2=CC=C(C=C2)O)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C26H26N2O7/c1-15(18-8-10-21(29)11-9-18)12-13-35-26(31)23-17(3)27-16(2)22(25(30)34-4)24(23)19-6-5-7-20(14-19)28(32)33/h5-12,14,24,27,29H,13H2,1-4H3/b15-12+