3-methyl-1-(2-pyridin-4-ylpyrrolidin-1-yl)but-2-en-1-one

Systemtic Name: 3-methyl-1-(2-pyridin-4-ylpyrrolidin-1-yl)but-2-en-1-one Openeye Name: 3-methyl-1-[2-(4-pyridyl)pyrrolidin-1-yl]but-2-en-1-one CAS Name: 3-methyl-1-(2-pyridin-4-yl-1-pyrrolidinyl)-2-buten-1-one IUPAC Name: 3-methyl-1-(2-pyridin-4-ylpyrrolidin-1-yl)but-2-en-1-one Traditional Name: 3-methyl-1-[2-(4-pyridyl)pyrrolidino]but-2-en-1-one Formula: C14H18N2O MolecularWeight: 230.30552

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)N1CCCC1C2=CC=NC=C2)C

Isomeric SMILES

CC(=CC(=O)N1CCCC1C2=CC=NC=C2)C

InChI

InChI=1S/C14H18N2O/c1-11(2)10-14(17)16-9-3-4-13(16)12-5-7-15-8-6-12/h5-8,10,13H,3-4,9H2,1-2H3