1,3-bis[(1R)-1-(1,3-benzodioxol-5-yl)butyl]urea

Systemtic Name: 1,3-bis[(1R)-1-(1,3-benzodioxol-5-yl)butyl]urea Openeye Name: 1,3-bis[(1R)-1-(1,3-benzodioxol-5-yl)butyl]urea CAS Name: 1,3-bis[(1R)-1-(1,3-benzodioxol-5-yl)butyl]urea IUPAC Name: 1,3-bis[(1R)-1-(1,3-benzodioxol-5-yl)butyl]urea Traditional Name: 1,3-bis[(1R)-1-(1,3-benzodioxol-5-yl)butyl]urea Formula: C23H28N2O5 MolecularWeight: 412.47882

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC2=C(C=C1)OCO2)NC(=O)NC(CCC)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCC[C@H](C1=CC2=C(C=C1)OCO2)NC(=O)N[C@H](CCC)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C23H28N2O5/c1-3-5-17(15-7-9-19-21(11-15)29-13-27-19)24-23(26)25-18(6-4-2)16-8-10-20-22(12-16)30-14-28-20/h7-12,17-18H,3-6,13-14H2,1-2H3,(H2,24,25,26)/t17-,18-/m1/s1