3-methyl-3-[(E)-3-(3-pyridin-4-yloxiran-2-yl)prop-2-enyl]pentane-2,4-dione

Systemtic Name: 3-methyl-3-[(E)-3-(3-pyridin-4-yloxiran-2-yl)prop-2-enyl]pentane-2,4-dione Openeye Name: 3-methyl-3-[(E)-3-[3-(4-pyridyl)oxiran-2-yl]allyl]pentane-2,4-dione CAS Name: 3-methyl-3-[(E)-3-(3-pyridin-4-yl-2-oxiranyl)prop-2-enyl]pentane-2,4-dione IUPAC Name: 3-methyl-3-[(E)-3-(3-pyridin-4-yloxiran-2-yl)prop-2-enyl]pentane-2,4-dione Traditional Name: 3-methyl-3-[(E)-3-[3-(4-pyridyl)oxiran-2-yl]allyl]pentane-2,4-dione Formula: C16H19NO3 MolecularWeight: 273.32696

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C)(CC=CC1C(O1)C2=CC=NC=C2)C(=O)C

Isomeric SMILES

CC(=O)C(C)(C/C=C/C1C(O1)C2=CC=NC=C2)C(=O)C

InChI

InChI=1S/C16H19NO3/c1-11(18)16(3,12(2)19)8-4-5-14-15(20-14)13-6-9-17-10-7-13/h4-7,9-10,14-15H,8H2,1-3H3/b5-4+