ethyl 5-(ethylcarbamoyl)-2-methyl-6-phenyl-4-(2-phenylethynyl)-1,4-dihydropyridine-3-carboxylate

Systemtic Name: ethyl 5-(ethylcarbamoyl)-2-methyl-6-phenyl-4-(2-phenylethynyl)-1,4-dihydropyridine-3-carboxylate Openeye Name: ethyl 5-(ethylcarbamoyl)-2-methyl-6-phenyl-4-(2-phenylethynyl)-1,4-dihydropyridine-3-carboxylate CAS Name: 5-(ethylcarbamoyl)-2-methyl-6-phenyl-4-(2-phenylethynyl)-1,4-dihydropyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-(ethylcarbamoyl)-2-methyl-6-phenyl-4-(2-phenylethynyl)-1,4-dihydropyridine-3-carboxylate Traditional Name: 5-(ethylcarbamoyl)-2-methyl-6-phenyl-4-(2-phenylethynyl)-1,4-dihydropyridine-3-carboxylic acid ethyl ester Formula: C26H26N2O3 MolecularWeight: 414.49624

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1=C(NC(=C(C1C#CC2=CC=CC=C2)C(=O)OCC)C)C3=CC=CC=C3

Isomeric SMILES

CCNC(=O)C1=C(NC(=C(C1C#CC2=CC=CC=C2)C(=O)OCC)C)C3=CC=CC=C3

InChI

InChI=1S/C26H26N2O3/c1-4-27-25(29)23-21(17-16-19-12-8-6-9-13-19)22(26(30)31-5-2)18(3)28-24(23)20-14-10-7-11-15-20/h6-15,21,28H,4-5H2,1-3H3,(H,27,29)