1-(1,3-benzodioxol-5-ylmethyl)-3-(2-methoxy-5-methyl-phenyl)-1-[1-(phenylmethyl)piperidin-4-yl]urea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(2-methoxy-5-methyl-phenyl)-1-[1-(phenylmethyl)piperidin-4-yl]urea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-1-(1-benzyl-4-piperidyl)-3-(2-methoxy-5-methyl-phenyl)urea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(2-methoxy-5-methylphenyl)-1-[1-(phenylmethyl)-4-piperidinyl]urea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-1-(1-benzylpiperidin-4-yl)-3-(2-methoxy-5-methylphenyl)urea Traditional Name: 1-(1-benzyl-4-piperidyl)-3-(2-methoxy-5-methyl-phenyl)-1-piperonyl-urea Formula: C29H33N3O4 MolecularWeight: 487.59002

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)NC(=O)N(CC2=CC3=C(C=C2)OCO3)C4CCN(CC4)CC5=CC=CC=C5

Isomeric SMILES

CC1=CC(=C(C=C1)OC)NC(=O)N(CC2=CC3=C(C=C2)OCO3)C4CCN(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C29H33N3O4/c1-21-8-10-26(34-2)25(16-21)30-29(33)32(19-23-9-11-27-28(17-23)36-20-35-27)24-12-14-31(15-13-24)18-22-6-4-3-5-7-22/h3-11,16-17,24H,12-15,18-20H2,1-2H3,(H,30,33)