1-(4-methylpiperazin-1-yl)-3-(2-octadecoxyphenyl)propan-1-one hydrochloride

Systemtic Name: 1-(4-methylpiperazin-1-yl)-3-(2-octadecoxyphenyl)propan-1-one hydrochloride Openeye Name: 1-(4-methylpiperazin-1-yl)-3-(2-octadecoxyphenyl)propan-1-one hydrochloride CAS Name: 1-(4-methyl-1-piperazinyl)-3-(2-octadecoxyphenyl)-1-propanone hydrochloride IUPAC Name: 1-(4-methylpiperazin-1-yl)-3-(2-octadecoxyphenyl)propan-1-one hydrochloride Traditional Name: 1-(4-methylpiperazino)-3-(2-stearyloxyphenyl)propan-1-one hydrochloride Formula: C32H57ClN2O2 MolecularWeight: 537.26018

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC1=CC=CC=C1CCC(=O)N2CCN(CC2)C.Cl

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC1=CC=CC=C1CCC(=O)N2CCN(CC2)C.Cl

InChI

InChI=1S/C32H56N2O2.ClH/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-29-36-31-22-19-18-21-30(31)23-24-32(35)34-27-25-33(2)26-28-34;/h18-19,21-22H,3-17,20,23-29H2,1-2H3;1H