2,6-dimethyl-4-(2-phenylethynyl)-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: 2,6-dimethyl-4-(2-phenylethynyl)-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: 2,6-dimethyl-4-(2-phenylethynyl)-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2,6-dimethyl-4-(2-phenylethynyl)-1,4-dihydropyridine-3,5-dicarboxylate IUPAC Name: 2,6-dimethyl-4-(2-phenylethynyl)-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 2,6-dimethyl-4-(2-phenylethynyl)-1,4-dihydropyridine-3,5-dicarboxylate Formula: C17H13NO4-2 MolecularWeight: 295.28942

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)C(=O)[O-])C#CC2=CC=CC=C2)C(=O)[O-]

Isomeric SMILES

CC1=C(C(C(=C(N1)C)C(=O)[O-])C#CC2=CC=CC=C2)C(=O)[O-]

InChI

InChI=1S/C17H15NO4/c1-10-14(16(19)20)13(15(17(21)22)11(2)18-10)9-8-12-6-4-3-5-7-12/h3-7,13,18H,1-2H3,(H,19,20)(H,21,22)/p-2