1-[3-[4-(1,3-benzodioxol-5-ylmethyl)piperidin-1-yl]propyl]-3-(3-cyanophenyl)urea

Systemtic Name: 1-[3-[4-(1,3-benzodioxol-5-ylmethyl)piperidin-1-yl]propyl]-3-(3-cyanophenyl)urea Openeye Name: 1-[3-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperidyl]propyl]-3-(3-cyanophenyl)urea CAS Name: 1-[3-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperidinyl]propyl]-3-(3-cyanophenyl)urea IUPAC Name: 1-[3-[4-(1,3-benzodioxol-5-ylmethyl)piperidin-1-yl]propyl]-3-(3-cyanophenyl)urea Traditional Name: 1-(3-cyanophenyl)-3-[3-(4-piperonylpiperidino)propyl]urea Formula: C24H28N4O3 MolecularWeight: 420.50412

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC3=C(C=C2)OCO3)CCCNC(=O)NC4=CC=CC(=C4)C#N

Isomeric SMILES

C1CN(CCC1CC2=CC3=C(C=C2)OCO3)CCCNC(=O)NC4=CC=CC(=C4)C#N

InChI

InChI=1S/C24H28N4O3/c25-16-20-3-1-4-21(14-20)27-24(29)26-9-2-10-28-11-7-18(8-12-28)13-19-5-6-22-23(15-19)31-17-30-22/h1,3-6,14-15,18H,2,7-13,17H2,(H2,26,27,29)