5,5-dimethyl-2-propanoyl-3-(pyridin-4-ylamino)cyclohex-2-en-1-one

Systemtic Name: 5,5-dimethyl-2-propanoyl-3-(pyridin-4-ylamino)cyclohex-2-en-1-one Openeye Name: 5,5-dimethyl-2-propanoyl-3-(4-pyridylamino)cyclohex-2-en-1-one CAS Name: 5,5-dimethyl-2-(1-oxopropyl)-3-(pyridin-4-ylamino)-1-cyclohex-2-enone IUPAC Name: 5,5-dimethyl-2-propanoyl-3-(pyridin-4-ylamino)cyclohex-2-en-1-one Traditional Name: 5,5-dimethyl-2-propionyl-3-(4-pyridylamino)cyclohex-2-en-1-one Formula: C16H20N2O2 MolecularWeight: 272.3422

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=C(CC(CC1=O)(C)C)NC2=CC=NC=C2

Isomeric SMILES

CCC(=O)C1=C(CC(CC1=O)(C)C)NC2=CC=NC=C2

InChI

InChI=1S/C16H20N2O2/c1-4-13(19)15-12(9-16(2,3)10-14(15)20)18-11-5-7-17-8-6-11/h5-8H,4,9-10H2,1-3H3,(H,17,18)