methyl 6-(2-but-3-enoylpyrazolidin-1-yl)carbonylpyridine-3-carboxylate

Systemtic Name: methyl 6-(2-but-3-enoylpyrazolidin-1-yl)carbonylpyridine-3-carboxylate Openeye Name: methyl 6-(2-but-3-enoylpyrazolidine-1-carbonyl)pyridine-3-carboxylate CAS Name: 6-[oxo-[2-(1-oxobut-3-enyl)-1-pyrazolidinyl]methyl]-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 6-(2-but-3-enoylpyrazolidine-1-carbonyl)pyridine-3-carboxylate Traditional Name: 6-(2-but-3-enoylpyrazolidine-1-carbonyl)nicotinic acid methyl ester Formula: C15H17N3O4 MolecularWeight: 303.31318

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN=C(C=C1)C(=O)N2CCCN2C(=O)CC=C

Isomeric SMILES

COC(=O)C1=CN=C(C=C1)C(=O)N2CCCN2C(=O)CC=C

InChI

InChI=1S/C15H17N3O4/c1-3-5-13(19)17-8-4-9-18(17)14(20)12-7-6-11(10-16-12)15(21)22-2/h3,6-7,10H,1,4-5,8-9H2,2H3