1-[2-[3-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxidanyl-propoxy]phenyl]urea

Systemtic Name: 1-[2-[3-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxidanyl-propoxy]phenyl]urea Openeye Name: [2-[2-hydroxy-3-[4-(2-methoxyphenyl)piperazin-1-yl]propoxy]phenyl]urea CAS Name: [2-[2-hydroxy-3-[4-(2-methoxyphenyl)-1-piperazinyl]propoxy]phenyl]urea IUPAC Name: [2-[2-hydroxy-3-[4-(2-methoxyphenyl)piperazin-1-yl]propoxy]phenyl]urea Traditional Name: [2-[2-hydroxy-3-[4-(2-methoxyphenyl)piperazino]propoxy]phenyl]urea Formula: C21H28N4O4 MolecularWeight: 400.47142

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)CC(COC3=CC=CC=C3NC(=O)N)O

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)CC(COC3=CC=CC=C3NC(=O)N)O

InChI

InChI=1S/C21H28N4O4/c1-28-20-9-5-3-7-18(20)25-12-10-24(11-13-25)14-16(26)15-29-19-8-4-2-6-17(19)23-21(22)27/h2-9,16,26H,10-15H2,1H3,(H3,22,23,27)