N1',N7'-ditert-butyl-4,4-dicyano-N1,N7-bis(2-cyanophenyl)heptanediimidamide

Systemtic Name: N1',N7'-ditert-butyl-4,4-dicyano-N1,N7-bis(2-cyanophenyl)heptanediimidamide Openeye Name: N1',N7'-ditert-butyl-4,4-dicyano-N1,N7-bis(2-cyanophenyl)heptanediamidine CAS Name: N1',N7'-ditert-butyl-4,4-dicyano-N1,N7-bis(2-cyanophenyl)heptanediimidamide IUPAC Name: 1-N',7-N'-ditert-butyl-4,4-dicyano-1-N,7-N-bis(2-cyanophenyl)heptanediimidamide Traditional Name: N1',N7'-ditert-butyl-4,4-dicyano-N1,N7-bis(2-cyanophenyl)pimelamidine Formula: C31H36N8 MolecularWeight: 520.67114

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N=C(CCC(CCC(=NC(C)(C)C)NC1=CC=CC=C1C#N)(C#N)C#N)NC2=CC=CC=C2C#N

Isomeric SMILES

CC(C)(C)N=C(CCC(CCC(=NC(C)(C)C)NC1=CC=CC=C1C#N)(C#N)C#N)NC2=CC=CC=C2C#N

InChI

InChI=1S/C31H36N8/c1-29(2,3)38-27(36-25-13-9-7-11-23(25)19-32)15-17-31(21-34,22-35)18-16-28(39-30(4,5)6)37-26-14-10-8-12-24(26)20-33/h7-14H,15-18H2,1-6H3,(H,36,38)(H,37,39)