1-[4-[1-(4-cyclohexylphenyl)ethyl]piperazin-1-yl]-3-(2-oxidanylphenoxy)propan-1-one

Systemtic Name: 1-[4-[1-(4-cyclohexylphenyl)ethyl]piperazin-1-yl]-3-(2-oxidanylphenoxy)propan-1-one Openeye Name: 1-[4-[1-(4-cyclohexylphenyl)ethyl]piperazin-1-yl]-3-(2-hydroxyphenoxy)propan-1-one CAS Name: 1-[4-[1-(4-cyclohexylphenyl)ethyl]-1-piperazinyl]-3-(2-hydroxyphenoxy)-1-propanone IUPAC Name: 1-[4-[1-(4-cyclohexylphenyl)ethyl]piperazin-1-yl]-3-(2-hydroxyphenoxy)propan-1-one Traditional Name: 1-[4-[1-(4-cyclohexylphenyl)ethyl]piperazino]-3-(2-hydroxyphenoxy)propan-1-one Formula: C27H36N2O3 MolecularWeight: 436.58634

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)C2CCCCC2)N3CCN(CC3)C(=O)CCOC4=CC=CC=C4O

Isomeric SMILES

CC(C1=CC=C(C=C1)C2CCCCC2)N3CCN(CC3)C(=O)CCOC4=CC=CC=C4O

InChI

InChI=1S/C27H36N2O3/c1-21(22-11-13-24(14-12-22)23-7-3-2-4-8-23)28-16-18-29(19-17-28)27(31)15-20-32-26-10-6-5-9-25(26)30/h5-6,9-14,21,23,30H,2-4,7-8,15-20H2,1H3