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

Systemtic Name: 1-[(3,4-dichlorophenyl)methyl]-3-(4-methoxyphenyl)-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-[(3,4-dichlorophenyl)methyl]-3-(4-methoxyphenyl)urea; 2,2,2-trifluoroacetic acid CAS Name: 1-[(3,4-dichlorophenyl)methyl]-3-(4-methoxyphenyl)-1-[3-[4-(phenylmethyl)-1-piperidinyl]propyl]urea; 2,2,2-trifluoroacetic acid IUPAC Name: 1-[3-(4-benzylpiperidin-1-yl)propyl]-1-[(3,4-dichlorophenyl)methyl]-3-(4-methoxyphenyl)urea; 2,2,2-trifluoroacetic acid Traditional Name: 1-[3-(4-benzylpiperidino)propyl]-1-(3,4-dichlorobenzyl)-3-(4-methoxyphenyl)urea; 2,2,2-trifluoroacetic acid Formula: C32H36Cl2F3N3O4 MolecularWeight: 654.54715

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)N(CCCN2CCC(CC2)CC3=CC=CC=C3)CC4=CC(=C(C=C4)Cl)Cl.C(=O)(C(F)(F)F)O

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)N(CCCN2CCC(CC2)CC3=CC=CC=C3)CC4=CC(=C(C=C4)Cl)Cl.C(=O)(C(F)(F)F)O

InChI

InChI=1S/C30H35Cl2N3O2.C2HF3O2/c1-37-27-11-9-26(10-12-27)33-30(36)35(22-25-8-13-28(31)29(32)21-25)17-5-16-34-18-14-24(15-19-34)20-23-6-3-2-4-7-23;3-2(4,5)1(6)7/h2-4,6-13,21,24H,5,14-20,22H2,1H3,(H,33,36);(H,6,7)