tetramethyl 5-pyridin-2-ylhepta-2,4-dien-6-yne-1,2,3,4-tetracarboxylate

Systemtic Name: tetramethyl 5-pyridin-2-ylhepta-2,4-dien-6-yne-1,2,3,4-tetracarboxylate Openeye Name: tetramethyl 5-(2-pyridyl)hepta-2,4-dien-6-yne-1,2,3,4-tetracarboxylate CAS Name: 5-(2-pyridinyl)hepta-2,4-dien-6-yne-1,2,3,4-tetracarboxylic acid tetramethyl ester IUPAC Name: tetramethyl 5-pyridin-2-ylhepta-2,4-dien-6-yne-1,2,3,4-tetracarboxylate Traditional Name: 5-(2-pyridyl)hepta-2,4-dien-6-yne-1,2,3,4-tetracarboxylic acid tetramethyl ester Formula: C20H19NO8 MolecularWeight: 401.36676

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(=C(C(=C(C#C)C1=CC=CC=N1)C(=O)OC)C(=O)OC)C(=O)OC

Isomeric SMILES

COC(=O)CC(=C(C(=C(C#C)C1=CC=CC=N1)C(=O)OC)C(=O)OC)C(=O)OC

InChI

InChI=1S/C20H19NO8/c1-6-12(14-9-7-8-10-21-14)16(19(24)28-4)17(20(25)29-5)13(18(23)27-3)11-15(22)26-2/h1,7-10H,11H2,2-5H3