[3-[(E)-2-methyl-3-(4-tetradecoxyphenyl)prop-2-enoyl]oxy-2-pyridin-3-ylcarbonyloxy-propyl] pyridine-3-carboxylate

Systemtic Name: [3-[(E)-2-methyl-3-(4-tetradecoxyphenyl)prop-2-enoyl]oxy-2-pyridin-3-ylcarbonyloxy-propyl] pyridine-3-carboxylate Openeye Name: [3-[(E)-2-methyl-3-(4-tetradecoxyphenyl)prop-2-enoyl]oxy-2-(pyridine-3-carbonyloxy)propyl] pyridine-3-carboxylate CAS Name: 3-pyridinecarboxylic acid [3-[(E)-2-methyl-1-oxo-3-(4-tetradecoxyphenyl)prop-2-enoxy]-2-[oxo(3-pyridinyl)methoxy]propyl] ester IUPAC Name: [3-[(E)-2-methyl-3-(4-tetradecoxyphenyl)prop-2-enoyl]oxy-2-(pyridine-3-carbonyloxy)propyl] pyridine-3-carboxylate Traditional Name: nicotinic acid [3-[(E)-2-methyl-3-(4-myristyloxyphenyl)acryloyl]oxy-2-nicotinoyloxy-propyl] ester Formula: C39H50N2O7 MolecularWeight: 658.8235

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=CC=C(C=C1)C=C(C)C(=O)OCC(COC(=O)C2=CN=CC=C2)OC(=O)C3=CN=CC=C3

Isomeric SMILES

CCCCCCCCCCCCCCOC1=CC=C(C=C1)/C=C(\C)/C(=O)OCC(COC(=O)C2=CN=CC=C2)OC(=O)C3=CN=CC=C3

InChI

InChI=1S/C39H50N2O7/c1-3-4-5-6-7-8-9-10-11-12-13-14-25-45-35-21-19-32(20-22-35)26-31(2)37(42)46-29-36(48-39(44)34-18-16-24-41-28-34)30-47-38(43)33-17-15-23-40-27-33/h15-24,26-28,36H,3-14,25,29-30H2,1-2H3/b31-26+