N,N'-bis[(E)-1-[3-(cyclohexylcarbonylamino)phenyl]ethylideneamino]heptanediamide

Systemtic Name: N,N'-bis[(E)-1-[3-(cyclohexylcarbonylamino)phenyl]ethylideneamino]heptanediamide Openeye Name: N,N'-bis[(E)-1-[3-(cyclohexanecarbonylamino)phenyl]ethylideneamino]heptanediamide CAS Name: N,N'-bis[(E)-1-[3-[[cyclohexyl(oxo)methyl]amino]phenyl]ethylideneamino]heptanediamide IUPAC Name: N,N'-bis[(E)-1-[3-(cyclohexanecarbonylamino)phenyl]ethylideneamino]heptanediamide Traditional Name: N,N'-bis[(E)-1-[3-(cyclohexanecarbonylamino)phenyl]ethylideneamino]pimelamide Formula: C37H50N6O4 MolecularWeight: 642.8307

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)CCCCCC(=O)NN=C(C)C1=CC(=CC=C1)NC(=O)C2CCCCC2)C3=CC(=CC=C3)NC(=O)C4CCCCC4

Isomeric SMILES

C/C(=N\NC(=O)CCCCCC(=O)N/N=C(/C1=CC(=CC=C1)NC(=O)C2CCCCC2)\C)/C3=CC(=CC=C3)NC(=O)C4CCCCC4

InChI

InChI=1S/C37H50N6O4/c1-26(30-18-12-20-32(24-30)38-36(46)28-14-6-3-7-15-28)40-42-34(44)22-10-5-11-23-35(45)43-41-27(2)31-19-13-21-33(25-31)39-37(47)29-16-8-4-9-17-29/h12-13,18-21,24-25,28-29H,3-11,14-17,22-23H2,1-2H3,(H,38,46)(H,39,47)(H,42,44)(H,43,45)/b40-26+,41-27+