N1,N3-bis[3-[3-(pyrrolidin-1-ylmethyl)phenoxy]propyl]benzene-1,3-dicarboxamide

Systemtic Name: N1,N3-bis[3-[3-(pyrrolidin-1-ylmethyl)phenoxy]propyl]benzene-1,3-dicarboxamide Openeye Name: N1,N3-bis[3-[3-(pyrrolidin-1-ylmethyl)phenoxy]propyl]benzene-1,3-dicarboxamide CAS Name: N1,N3-bis[3-[3-(1-pyrrolidinylmethyl)phenoxy]propyl]benzene-1,3-dicarboxamide IUPAC Name: 1-N,3-N-bis[3-[3-(pyrrolidin-1-ylmethyl)phenoxy]propyl]benzene-1,3-dicarboxamide Traditional Name: N,N'-bis[3-[3-(pyrrolidinomethyl)phenoxy]propyl]isophthalamide Formula: C36H46N4O4 MolecularWeight: 598.77484

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2=CC(=CC=C2)OCCCNC(=O)C3=CC(=CC=C3)C(=O)NCCCOC4=CC=CC(=C4)CN5CCCC5

Isomeric SMILES

C1CCN(C1)CC2=CC(=CC=C2)OCCCNC(=O)C3=CC(=CC=C3)C(=O)NCCCOC4=CC=CC(=C4)CN5CCCC5

InChI

InChI=1S/C36H46N4O4/c41-35(37-16-8-22-43-33-14-5-10-29(24-33)27-39-18-1-2-19-39)31-12-7-13-32(26-31)36(42)38-17-9-23-44-34-15-6-11-30(25-34)28-40-20-3-4-21-40/h5-7,10-15,24-26H,1-4,8-9,16-23,27-28H2,(H,37,41)(H,38,42)