2-(2,5-dimethylphenoxy)-1-(3,3-dimethylpiperidin-1-yl)butan-1-one

Systemtic Name: 2-(2,5-dimethylphenoxy)-1-(3,3-dimethylpiperidin-1-yl)butan-1-one Openeye Name: 2-(2,5-dimethylphenoxy)-1-(3,3-dimethyl-1-piperidyl)butan-1-one CAS Name: 2-(2,5-dimethylphenoxy)-1-(3,3-dimethyl-1-piperidinyl)-1-butanone IUPAC Name: 2-(2,5-dimethylphenoxy)-1-(3,3-dimethylpiperidin-1-yl)butan-1-one Traditional Name: 2-(2,5-dimethylphenoxy)-1-(3,3-dimethylpiperidino)butan-1-one Formula: C19H29NO2 MolecularWeight: 303.43906

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N1CCCC(C1)(C)C)OC2=C(C=CC(=C2)C)C

Isomeric SMILES

CCC(C(=O)N1CCCC(C1)(C)C)OC2=C(C=CC(=C2)C)C

InChI

InChI=1S/C19H29NO2/c1-6-16(22-17-12-14(2)8-9-15(17)3)18(21)20-11-7-10-19(4,5)13-20/h8-9,12,16H,6-7,10-11,13H2,1-5H3