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

Systemtic Name: O5-ethyl O3-(phenylmethyl) 2-cyclopropyl-6-methyl-4-(2-phenylethynyl)-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: O3-benzyl O5-ethyl 2-cyclopropyl-6-methyl-4-(2-phenylethynyl)-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2-cyclopropyl-6-methyl-4-(2-phenylethynyl)-1,4-dihydropyridine-3,5-dicarboxylic acid O5-ethyl ester O3-(phenylmethyl) ester IUPAC Name: 3-O-benzyl 5-O-ethyl 2-cyclopropyl-6-methyl-4-(2-phenylethynyl)-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 2-cyclopropyl-6-methyl-4-(2-phenylethynyl)-1,4-dihydropyridine-3,5-dicarboxylic acid O3-benzyl ester O5-ethyl ester Formula: C28H27NO4 MolecularWeight: 441.51828

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C(C1C#CC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3)C4CC4)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C(C1C#CC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3)C4CC4)C

InChI

InChI=1S/C28H27NO4/c1-3-32-27(30)24-19(2)29-26(22-15-16-22)25(23(24)17-14-20-10-6-4-7-11-20)28(31)33-18-21-12-8-5-9-13-21/h4-13,22-23,29H,3,15-16,18H2,1-2H3