2,6-dimethyl-4-(3-nitrophenyl)-5-[(E)-4-phenylbut-3-enoxy]carbonyl-1,4-dihydropyridine-3-carboxylic acid

Systemtic Name: 2,6-dimethyl-4-(3-nitrophenyl)-5-[(E)-4-phenylbut-3-enoxy]carbonyl-1,4-dihydropyridine-3-carboxylic acid Openeye Name: 2,6-dimethyl-4-(3-nitrophenyl)-5-[(E)-4-phenylbut-3-enoxy]carbonyl-1,4-dihydropyridine-3-carboxylic acid CAS Name: 2,6-dimethyl-4-(3-nitrophenyl)-5-[oxo-[(E)-4-phenylbut-3-enoxy]methyl]-1,4-dihydropyridine-3-carboxylic acid IUPAC Name: 2,6-dimethyl-4-(3-nitrophenyl)-5-[(E)-4-phenylbut-3-enoxy]carbonyl-1,4-dihydropyridine-3-carboxylic acid Traditional Name: 2,6-dimethyl-4-(3-nitrophenyl)-5-[(E)-4-phenylbut-3-enoxy]carbonyl-1,4-dihydropyridine-3-carboxylic acid Formula: C25H24N2O6 MolecularWeight: 448.46786

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)C(=O)OCCC=CC2=CC=CC=C2)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C25H24N2O6/c1-16-21(24(28)29)23(19-12-8-13-20(15-19)27(31)32)22(17(2)26-16)25(30)33-14-7-6-11-18-9-4-3-5-10-18/h3-6,8-13,15,23,26H,7,14H2,1-2H3,(H,28,29)/b11-6+