N,N'-bis[(E)-1-(1-adamantyl)ethylideneamino]heptanediamide

Systemtic Name: N,N'-bis[(E)-1-(1-adamantyl)ethylideneamino]heptanediamide Openeye Name: N,N'-bis[(E)-1-(1-adamantyl)ethylideneamino]heptanediamide CAS Name: N,N'-bis[(E)-1-(1-adamantyl)ethylideneamino]heptanediamide IUPAC Name: N,N'-bis[(E)-1-(1-adamantyl)ethylideneamino]heptanediamide Traditional Name: N,N'-bis[(E)-1-(1-adamantyl)ethylideneamino]pimelamide Formula: C31H48N4O2 MolecularWeight: 508.73842

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)CCCCCC(=O)NN=C(C)C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

C/C(=N\NC(=O)CCCCCC(=O)N/N=C(/C12CC3CC(C1)CC(C2)C3)\C)/C45CC6CC(C4)CC(C5)C6

InChI

InChI=1S/C31H48N4O2/c1-20(30-14-22-8-23(15-30)10-24(9-22)16-30)32-34-28(36)6-4-3-5-7-29(37)35-33-21(2)31-17-25-11-26(18-31)13-27(12-25)19-31/h22-27H,3-19H2,1-2H3,(H,34,36)(H,35,37)/b32-20+,33-21+