1-[3-[1,3-benzodioxol-5-ylmethyl(3-methylbutyl)amino]propyl]-3-(2-phenylphenyl)urea

Systemtic Name: 1-[3-[1,3-benzodioxol-5-ylmethyl(3-methylbutyl)amino]propyl]-3-(2-phenylphenyl)urea Openeye Name: 1-[3-[1,3-benzodioxol-5-ylmethyl(isopentyl)amino]propyl]-3-(2-phenylphenyl)urea CAS Name: 1-[3-[1,3-benzodioxol-5-ylmethyl(3-methylbutyl)amino]propyl]-3-(2-phenylphenyl)urea IUPAC Name: 1-[3-[1,3-benzodioxol-5-ylmethyl(3-methylbutyl)amino]propyl]-3-(2-phenylphenyl)urea Traditional Name: 1-[3-[isoamyl(piperonyl)amino]propyl]-3-(2-phenylphenyl)urea Formula: C29H35N3O3 MolecularWeight: 473.6065

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN(CCCNC(=O)NC1=CC=CC=C1C2=CC=CC=C2)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC(C)CCN(CCCNC(=O)NC1=CC=CC=C1C2=CC=CC=C2)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C29H35N3O3/c1-22(2)15-18-32(20-23-13-14-27-28(19-23)35-21-34-27)17-8-16-30-29(33)31-26-12-7-6-11-25(26)24-9-4-3-5-10-24/h3-7,9-14,19,22H,8,15-18,20-21H2,1-2H3,(H2,30,31,33)