1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-3-[[3-(pyrrolidin-1-ylmethyl)phenyl]methyl]urea

Systemtic Name: 1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-3-[[3-(pyrrolidin-1-ylmethyl)phenyl]methyl]urea Openeye Name: 1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-3-[[3-(pyrrolidin-1-ylmethyl)phenyl]methyl]urea CAS Name: 1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-3-[[3-(1-pyrrolidinylmethyl)phenyl]methyl]urea IUPAC Name: 1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-3-[[3-(pyrrolidin-1-ylmethyl)phenyl]methyl]urea Traditional Name: 1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-3-[3-(pyrrolidinomethyl)benzyl]urea Formula: C22H27N3O3 MolecularWeight: 381.46808

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2=CC(=CC=C2)CNC(=O)NCC3COC4=CC=CC=C4O3

Isomeric SMILES

C1CCN(C1)CC2=CC(=CC=C2)CNC(=O)NCC3COC4=CC=CC=C4O3

InChI

InChI=1S/C22H27N3O3/c26-22(24-14-19-16-27-20-8-1-2-9-21(20)28-19)23-13-17-6-5-7-18(12-17)15-25-10-3-4-11-25/h1-2,5-9,12,19H,3-4,10-11,13-16H2,(H2,23,24,26)