1-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-oxidanyl-3-pyrrolidin-1-yl-propan-2-yl]-3-(4-phenylbutyl)urea

Systemtic Name: 1-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-oxidanyl-3-pyrrolidin-1-yl-propan-2-yl]-3-(4-phenylbutyl)urea Openeye Name: 1-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-hydroxy-1-(pyrrolidin-1-ylmethyl)ethyl]-3-(4-phenylbutyl)urea CAS Name: 1-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-hydroxy-3-(1-pyrrolidinyl)propan-2-yl]-3-(4-phenylbutyl)urea IUPAC Name: 1-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-hydroxy-3-pyrrolidin-1-ylpropan-2-yl]-3-(4-phenylbutyl)urea Traditional Name: 1-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-hydroxy-1-(pyrrolidinomethyl)ethyl]-3-(4-phenylbutyl)urea Formula: C26H35N3O4 MolecularWeight: 453.5738

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC(C(C2=CC3=C(C=C2)OCCO3)O)NC(=O)NCCCCC4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)CC(C(C2=CC3=C(C=C2)OCCO3)O)NC(=O)NCCCCC4=CC=CC=C4

InChI

InChI=1S/C26H35N3O4/c30-25(21-11-12-23-24(18-21)33-17-16-32-23)22(19-29-14-6-7-15-29)28-26(31)27-13-5-4-10-20-8-2-1-3-9-20/h1-3,8-9,11-12,18,22,25,30H,4-7,10,13-17,19H2,(H2,27,28,31)