3,6-bis(3-pyrrolidin-1-ylpropoxy)xanthen-9-one

Systemtic Name: 3,6-bis(3-pyrrolidin-1-ylpropoxy)xanthen-9-one Openeye Name: 3,6-bis(3-pyrrolidin-1-ylpropoxy)xanthen-9-one CAS Name: 3,6-bis[3-(1-pyrrolidinyl)propoxy]-9-xanthenone IUPAC Name: 3,6-bis(3-pyrrolidin-1-ylpropoxy)xanthen-9-one Traditional Name: 3,6-bis(3-pyrrolidinopropoxy)xanthone Formula: C27H34N2O4 MolecularWeight: 450.56986

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCCOC2=CC3=C(C=C2)C(=O)C4=C(O3)C=C(C=C4)OCCCN5CCCC5

Isomeric SMILES

C1CCN(C1)CCCOC2=CC3=C(C=C2)C(=O)C4=C(O3)C=C(C=C4)OCCCN5CCCC5

InChI

InChI=1S/C27H34N2O4/c30-27-23-9-7-21(31-17-5-15-28-11-1-2-12-28)19-25(23)33-26-20-22(8-10-24(26)27)32-18-6-16-29-13-3-4-14-29/h7-10,19-20H,1-6,11-18H2