3-(4-butylphenyl)-1-[(4-phenylmethoxyphenyl)methyl]-1-[1-(phenylmethyl)piperidin-4-yl]urea

Systemtic Name: 3-(4-butylphenyl)-1-[(4-phenylmethoxyphenyl)methyl]-1-[1-(phenylmethyl)piperidin-4-yl]urea Openeye Name: 1-[(4-benzyloxyphenyl)methyl]-1-(1-benzyl-4-piperidyl)-3-(4-butylphenyl)urea CAS Name: 3-(4-butylphenyl)-1-[(4-phenylmethoxyphenyl)methyl]-1-[1-(phenylmethyl)-4-piperidinyl]urea IUPAC Name: 1-(1-benzylpiperidin-4-yl)-3-(4-butylphenyl)-1-[(4-phenylmethoxyphenyl)methyl]urea Traditional Name: 1-(4-benzoxybenzyl)-1-(1-benzyl-4-piperidyl)-3-(4-butylphenyl)urea Formula: C37H43N3O2 MolecularWeight: 561.75622

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)N(CC2=CC=C(C=C2)OCC3=CC=CC=C3)C4CCN(CC4)CC5=CC=CC=C5

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)N(CC2=CC=C(C=C2)OCC3=CC=CC=C3)C4CCN(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C37H43N3O2/c1-2-3-10-30-15-19-34(20-16-30)38-37(41)40(35-23-25-39(26-24-35)27-31-11-6-4-7-12-31)28-32-17-21-36(22-18-32)42-29-33-13-8-5-9-14-33/h4-9,11-22,35H,2-3,10,23-29H2,1H3,(H,38,41)