O5-ethyl O3-(3-pyridin-3-ylprop-2-ynyl) 2-methyl-6-(4-morpholin-4-ylphenyl)-4-phenethyl-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: O5-ethyl O3-(3-pyridin-3-ylprop-2-ynyl) 2-methyl-6-(4-morpholin-4-ylphenyl)-4-phenethyl-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: O5-ethyl O3-[3-(3-pyridyl)prop-2-ynyl] 2-methyl-6-(4-morpholinophenyl)-4-phenethyl-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2-methyl-6-[4-(4-morpholinyl)phenyl]-4-phenethyl-1,4-dihydropyridine-3,5-dicarboxylic acid O5-ethyl ester O3-[3-(3-pyridinyl)prop-2-ynyl] ester IUPAC Name: 5-O-ethyl 3-O-(3-pyridin-3-ylprop-2-ynyl) 2-methyl-6-(4-morpholin-4-ylphenyl)-4-phenethyl-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 2-methyl-6-(4-morpholinophenyl)-4-phenethyl-1,4-dihydropyridine-3,5-dicarboxylic acid O5-ethyl ester O3-[3-(3-pyridyl)prop-2-ynyl] ester Formula: C36H37N3O5 MolecularWeight: 591.69608

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C(C1CCC2=CC=CC=C2)C(=O)OCC#CC3=CN=CC=C3)C)C4=CC=C(C=C4)N5CCOCC5

Isomeric SMILES

CCOC(=O)C1=C(NC(=C(C1CCC2=CC=CC=C2)C(=O)OCC#CC3=CN=CC=C3)C)C4=CC=C(C=C4)N5CCOCC5

InChI

InChI=1S/C36H37N3O5/c1-3-43-36(41)33-31(18-13-27-9-5-4-6-10-27)32(35(40)44-22-8-12-28-11-7-19-37-25-28)26(2)38-34(33)29-14-16-30(17-15-29)39-20-23-42-24-21-39/h4-7,9-11,14-17,19,25,31,38H,3,13,18,20-24H2,1-2H3