1-[2-(2,6-dimethoxypyridin-3-yl)carbonylpyrazolidin-1-yl]-3-methyl-but-2-en-1-one

Systemtic Name: 1-[2-(2,6-dimethoxypyridin-3-yl)carbonylpyrazolidin-1-yl]-3-methyl-but-2-en-1-one Openeye Name: 1-[2-(2,6-dimethoxypyridine-3-carbonyl)pyrazolidin-1-yl]-3-methyl-but-2-en-1-one CAS Name: 1-[2-[(2,6-dimethoxy-3-pyridinyl)-oxomethyl]-1-pyrazolidinyl]-3-methyl-2-buten-1-one IUPAC Name: 1-[2-(2,6-dimethoxypyridine-3-carbonyl)pyrazolidin-1-yl]-3-methylbut-2-en-1-one Traditional Name: 1-[2-(2,6-dimethoxynicotinoyl)pyrazolidin-1-yl]-3-methyl-but-2-en-1-one Formula: C16H21N3O4 MolecularWeight: 319.35564

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)N1CCCN1C(=O)C2=C(N=C(C=C2)OC)OC)C

Isomeric SMILES

CC(=CC(=O)N1CCCN1C(=O)C2=C(N=C(C=C2)OC)OC)C

InChI

InChI=1S/C16H21N3O4/c1-11(2)10-14(20)18-8-5-9-19(18)16(21)12-6-7-13(22-3)17-15(12)23-4/h6-7,10H,5,8-9H2,1-4H3