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

Systemtic Name: 2-[4-[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butanoyl]piperazin-1-yl]benzenediazonium Openeye Name: 2-[4-[4-[2,4-bis(1,1-dimethylpropyl)phenoxy]butanoyl]piperazin-1-yl]benzenediazonium CAS Name: 2-[4-[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]-1-oxobutyl]-1-piperazinyl]benzenediazonium IUPAC Name: 2-[4-[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butanoyl]piperazin-1-yl]benzenediazonium Traditional Name: 2-[4-[4-(2,4-ditert-amylphenoxy)butanoyl]piperazino]benzenediazonium Formula: C30H43N4O2+ MolecularWeight: 491.68802

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC(=C(C=C1)OCCCC(=O)N2CCN(CC2)C3=CC=CC=C3[N+]#N)C(C)(C)CC

Isomeric SMILES

CCC(C)(C)C1=CC(=C(C=C1)OCCCC(=O)N2CCN(CC2)C3=CC=CC=C3[N+]#N)C(C)(C)CC

InChI

InChI=1S/C30H43N4O2/c1-7-29(3,4)23-15-16-27(24(22-23)30(5,6)8-2)36-21-11-14-28(35)34-19-17-33(18-20-34)26-13-10-9-12-25(26)32-31/h9-10,12-13,15-16,22H,7-8,11,14,17-21H2,1-6H3/q+1