O3-methyl O5-(phenylmethyl) 2-methyl-6-phenyl-4-(2-phenylethynyl)-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: O3-methyl O5-(phenylmethyl) 2-methyl-6-phenyl-4-(2-phenylethynyl)-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: O5-benzyl O3-methyl 2-methyl-6-phenyl-4-(2-phenylethynyl)-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2-methyl-6-phenyl-4-(2-phenylethynyl)-1,4-dihydropyridine-3,5-dicarboxylic acid O3-methyl ester O5-(phenylmethyl) ester IUPAC Name: 5-O-benzyl 3-O-methyl 2-methyl-6-phenyl-4-(2-phenylethynyl)-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 2-methyl-6-phenyl-4-(2-phenylethynyl)-1,4-dihydropyridine-3,5-dicarboxylic acid O5-benzyl ester O3-methyl ester Formula: C30H25NO4 MolecularWeight: 463.5238

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C2=CC=CC=C2)C(=O)OCC3=CC=CC=C3)C#CC4=CC=CC=C4)C(=O)OC

Isomeric SMILES

CC1=C(C(C(=C(N1)C2=CC=CC=C2)C(=O)OCC3=CC=CC=C3)C#CC4=CC=CC=C4)C(=O)OC

InChI

InChI=1S/C30H25NO4/c1-21-26(29(32)34-2)25(19-18-22-12-6-3-7-13-22)27(28(31-21)24-16-10-5-11-17-24)30(33)35-20-23-14-8-4-9-15-23/h3-17,25,31H,20H2,1-2H3