1-[(2-chlorophenyl)methyl]-3-cyclohexyl-1-[3-[4-(phenylmethyl)piperidin-1-yl]propyl]urea; 2,2,2-tris(fluoranyl)ethanoic acid

Systemtic Name: 1-[(2-chlorophenyl)methyl]-3-cyclohexyl-1-[3-[4-(phenylmethyl)piperidin-1-yl]propyl]urea; 2,2,2-tris(fluoranyl)ethanoic acid Openeye Name: 1-[3-(4-benzyl-1-piperidyl)propyl]-1-[(2-chlorophenyl)methyl]-3-cyclohexyl-urea; 2,2,2-trifluoroacetic acid CAS Name: 1-[(2-chlorophenyl)methyl]-3-cyclohexyl-1-[3-[4-(phenylmethyl)-1-piperidinyl]propyl]urea; 2,2,2-trifluoroacetic acid IUPAC Name: 1-[3-(4-benzylpiperidin-1-yl)propyl]-1-[(2-chlorophenyl)methyl]-3-cyclohexylurea; 2,2,2-trifluoroacetic acid Traditional Name: 1-[3-(4-benzylpiperidino)propyl]-1-(2-chlorobenzyl)-3-cyclohexyl-urea; 2,2,2-trifluoroacetic acid Formula: C31H41ClF3N3O3 MolecularWeight: 596.12375

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)N(CCCN2CCC(CC2)CC3=CC=CC=C3)CC4=CC=CC=C4Cl.C(=O)(C(F)(F)F)O

Isomeric SMILES

C1CCC(CC1)NC(=O)N(CCCN2CCC(CC2)CC3=CC=CC=C3)CC4=CC=CC=C4Cl.C(=O)(C(F)(F)F)O

InChI

InChI=1S/C29H40ClN3O.C2HF3O2/c30-28-15-8-7-12-26(28)23-33(29(34)31-27-13-5-2-6-14-27)19-9-18-32-20-16-25(17-21-32)22-24-10-3-1-4-11-24;3-2(4,5)1(6)7/h1,3-4,7-8,10-12,15,25,27H,2,5-6,9,13-14,16-23H2,(H,31,34);(H,6,7)