3,6-bis[3-(azetidin-1-yl)propoxy]xanthen-9-one

Systemtic Name: 3,6-bis[3-(azetidin-1-yl)propoxy]xanthen-9-one Openeye Name: 3,6-bis[3-(azetidin-1-yl)propoxy]xanthen-9-one CAS Name: 3,6-bis[3-(1-azetidinyl)propoxy]-9-xanthenone IUPAC Name: 3,6-bis[3-(azetidin-1-yl)propoxy]xanthen-9-one Traditional Name: 3,6-bis[3-(azetidin-1-yl)propoxy]xanthone Formula: C25H30N2O4 MolecularWeight: 422.5167

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(C1)CCCOC2=CC3=C(C=C2)C(=O)C4=C(O3)C=C(C=C4)OCCCN5CCC5

Isomeric SMILES

C1CN(C1)CCCOC2=CC3=C(C=C2)C(=O)C4=C(O3)C=C(C=C4)OCCCN5CCC5

InChI

InChI=1S/C25H30N2O4/c28-25-21-7-5-19(29-15-3-13-26-9-1-10-26)17-23(21)31-24-18-20(6-8-22(24)25)30-16-4-14-27-11-2-12-27/h5-8,17-18H,1-4,9-16H2