3-(2-tert-butyl-6-methyl-phenoxy)-1-piperazin-1-yl-propan-1-one

Systemtic Name: 3-(2-tert-butyl-6-methyl-phenoxy)-1-piperazin-1-yl-propan-1-one Openeye Name: 3-(2-tert-butyl-6-methyl-phenoxy)-1-piperazin-1-yl-propan-1-one CAS Name: 3-(2-tert-butyl-6-methylphenoxy)-1-(1-piperazinyl)-1-propanone IUPAC Name: 3-(2-tert-butyl-6-methylphenoxy)-1-piperazin-1-ylpropan-1-one Traditional Name: 3-(2-tert-butyl-6-methyl-phenoxy)-1-piperazino-propan-1-one Formula: C18H28N2O2 MolecularWeight: 304.42712

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C(C)(C)C)OCCC(=O)N2CCNCC2

Isomeric SMILES

CC1=C(C(=CC=C1)C(C)(C)C)OCCC(=O)N2CCNCC2

InChI

InChI=1S/C18H28N2O2/c1-14-6-5-7-15(18(2,3)4)17(14)22-13-8-16(21)20-11-9-19-10-12-20/h5-7,19H,8-13H2,1-4H3