4-[1-[2-[2,4-bis(2-methylbutan-2-yl)phenoxy]butanoyl]piperazin-1-ium-1-yl]benzenediazonium

Systemtic Name: 4-[1-[2-[2,4-bis(2-methylbutan-2-yl)phenoxy]butanoyl]piperazin-1-ium-1-yl]benzenediazonium Openeye Name: 4-[1-[2-[2,4-bis(1,1-dimethylpropyl)phenoxy]butanoyl]piperazin-1-ium-1-yl]benzenediazonium CAS Name: 4-[1-[2-[2,4-bis(2-methylbutan-2-yl)phenoxy]-1-oxobutyl]-1-piperazin-1-iumyl]benzenediazonium IUPAC Name: 4-[1-[2-[2,4-bis(2-methylbutan-2-yl)phenoxy]butanoyl]piperazin-1-ium-1-yl]benzenediazonium Traditional Name: 4-[1-[2-(2,4-ditert-amylphenoxy)butanoyl]piperazin-1-ium-1-yl]benzenediazonium Formula: C30H44N4O2+2 MolecularWeight: 492.69596

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)[N+]1(CCNCC1)C2=CC=C(C=C2)[N+]#N)OC3=C(C=C(C=C3)C(C)(C)CC)C(C)(C)CC

Isomeric SMILES

CCC(C(=O)[N+]1(CCNCC1)C2=CC=C(C=C2)[N+]#N)OC3=C(C=C(C=C3)C(C)(C)CC)C(C)(C)CC

InChI

InChI=1S/C30H44N4O2/c1-8-26(28(35)34(19-17-32-18-20-34)24-14-12-23(33-31)13-15-24)36-27-16-11-22(29(4,5)9-2)21-25(27)30(6,7)10-3/h11-16,21,26,32H,8-10,17-20H2,1-7H3/q+2