4-[(3,5-dimethylphenyl)methyl]-5-ethyl-3-(prop-2-ynoxymethyl)-3H-pyridine-2,6-dione

Systemtic Name: 4-[(3,5-dimethylphenyl)methyl]-5-ethyl-3-(prop-2-ynoxymethyl)-3H-pyridine-2,6-dione Openeye Name: 4-[(3,5-dimethylphenyl)methyl]-5-ethyl-3-(prop-2-ynoxymethyl)-3H-pyridine-2,6-dione CAS Name: 4-[(3,5-dimethylphenyl)methyl]-5-ethyl-3-(prop-2-ynoxymethyl)-3H-pyridine-2,6-dione IUPAC Name: 4-[(3,5-dimethylphenyl)methyl]-5-ethyl-3-(prop-2-ynoxymethyl)-3H-pyridine-2,6-dione Traditional Name: 4-(3,5-dimethylbenzyl)-5-ethyl-3-(propargyloxymethyl)-3H-pyridine-2,6-quinone Formula: C20H23NO3 MolecularWeight: 325.40152

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(C(=O)NC1=O)COCC#C)CC2=CC(=CC(=C2)C)C

Isomeric SMILES

CCC1=C(C(C(=O)NC1=O)COCC#C)CC2=CC(=CC(=C2)C)C

InChI

InChI=1S/C20H23NO3/c1-5-7-24-12-18-17(16(6-2)19(22)21-20(18)23)11-15-9-13(3)8-14(4)10-15/h1,8-10,18H,6-7,11-12H2,2-4H3,(H,21,22,23)