O5-ethyl O3-(3-pyrimidin-5-ylprop-2-ynyl) 2-methyl-4-[(E)-2-phenylethenyl]-6-pyridin-3-yl-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: O5-ethyl O3-(3-pyrimidin-5-ylprop-2-ynyl) 2-methyl-4-[(E)-2-phenylethenyl]-6-pyridin-3-yl-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: O5-ethyl O3-(3-pyrimidin-5-ylprop-2-ynyl) 2-methyl-6-(3-pyridyl)-4-[(E)-styryl]-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2-methyl-4-[(E)-2-phenylethenyl]-6-(3-pyridinyl)-1,4-dihydropyridine-3,5-dicarboxylic acid O5-ethyl ester O3-[3-(5-pyrimidinyl)prop-2-ynyl] ester IUPAC Name: 5-O-ethyl 3-O-(3-pyrimidin-5-ylprop-2-ynyl) 2-methyl-4-[(E)-2-phenylethenyl]-6-pyridin-3-yl-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 2-methyl-6-(3-pyridyl)-4-[(E)-styryl]-1,4-dihydropyridine-3,5-dicarboxylic acid O5-ethyl ester O3-[3-(5-pyrimidyl)prop-2-ynyl] ester Formula: C30H26N4O4 MolecularWeight: 506.55184

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C(C1C=CC2=CC=CC=C2)C(=O)OCC#CC3=CN=CN=C3)C)C4=CN=CC=C4

Isomeric SMILES

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

InChI

InChI=1S/C30H26N4O4/c1-3-37-30(36)27-25(14-13-22-9-5-4-6-10-22)26(21(2)34-28(27)24-12-7-15-31-19-24)29(35)38-16-8-11-23-17-32-20-33-18-23/h4-7,9-10,12-15,17-20,25,34H,3,16H2,1-2H3/b14-13+