1-(2-ethoxyphenyl)-3-[4-(4-octanoylpiperazin-1-yl)phenyl]urea

Systemtic Name: 1-(2-ethoxyphenyl)-3-[4-(4-octanoylpiperazin-1-yl)phenyl]urea Openeye Name: 1-(2-ethoxyphenyl)-3-[4-(4-octanoylpiperazin-1-yl)phenyl]urea CAS Name: 1-(2-ethoxyphenyl)-3-[4-[4-(1-oxooctyl)-1-piperazinyl]phenyl]urea IUPAC Name: 1-(2-ethoxyphenyl)-3-[4-(4-octanoylpiperazin-1-yl)phenyl]urea Traditional Name: 1-[4-(4-caprylylpiperazino)phenyl]-3-o-phenetyl-urea Formula: C27H38N4O3 MolecularWeight: 466.61562

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)NC3=CC=CC=C3OCC

Isomeric SMILES

CCCCCCCC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)NC3=CC=CC=C3OCC

InChI

InChI=1S/C27H38N4O3/c1-3-5-6-7-8-13-26(32)31-20-18-30(19-21-31)23-16-14-22(15-17-23)28-27(33)29-24-11-9-10-12-25(24)34-4-2/h9-12,14-17H,3-8,13,18-21H2,1-2H3,(H2,28,29,33)