O3-methyl O5-(4-pyridin-3-ylbut-3-yn-2-yl) 2-(3-imidazol-1-ylphenyl)-6-methyl-4-phenethyl-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: O3-methyl O5-(4-pyridin-3-ylbut-3-yn-2-yl) 2-(3-imidazol-1-ylphenyl)-6-methyl-4-phenethyl-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: O3-methyl O5-[1-methyl-3-(3-pyridyl)prop-2-ynyl] 2-(3-imidazol-1-ylphenyl)-6-methyl-4-phenethyl-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2-[3-(1-imidazolyl)phenyl]-6-methyl-4-phenethyl-1,4-dihydropyridine-3,5-dicarboxylic acid O3-methyl ester O5-[4-(3-pyridinyl)but-3-yn-2-yl] ester IUPAC Name: 3-O-methyl 5-O-(4-pyridin-3-ylbut-3-yn-2-yl) 2-(3-imidazol-1-ylphenyl)-6-methyl-4-phenethyl-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 2-(3-imidazol-1-ylphenyl)-6-methyl-4-phenethyl-1,4-dihydropyridine-3,5-dicarboxylic acid O3-methyl ester O5-[1-methyl-3-(3-pyridyl)prop-2-ynyl] ester Formula: C35H32N4O4 MolecularWeight: 572.65298

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C2=CC(=CC=C2)N3C=CN=C3)C(=O)OC)CCC4=CC=CC=C4)C(=O)OC(C)C#CC5=CN=CC=C5

Isomeric SMILES

CC1=C(C(C(=C(N1)C2=CC(=CC=C2)N3C=CN=C3)C(=O)OC)CCC4=CC=CC=C4)C(=O)OC(C)C#CC5=CN=CC=C5

InChI

InChI=1S/C35H32N4O4/c1-24(14-15-27-11-8-18-36-22-27)43-35(41)31-25(2)38-33(28-12-7-13-29(21-28)39-20-19-37-23-39)32(34(40)42-3)30(31)17-16-26-9-5-4-6-10-26/h4-13,18-24,30,38H,16-17H2,1-3H3