1-[2-[diazonio-(3-methanoylphenyl)amino]-2-oxidanylidene-ethoxy]-2,4-bis(2-methylbutan-2-yl)benzene

Systemtic Name: 1-[2-[diazonio-(3-methanoylphenyl)amino]-2-oxidanylidene-ethoxy]-2,4-bis(2-methylbutan-2-yl)benzene Openeye Name: 1-[2-(N-diazonio-3-formyl-anilino)-2-oxo-ethoxy]-2,4-bis(1,1-dimethylpropyl)benzene CAS Name: 1-[2-(N-diazonio-3-formylanilino)-2-oxoethoxy]-2,4-bis(2-methylbutan-2-yl)benzene IUPAC Name: 1-[2-(N-diazonio-3-formylanilino)-2-oxoethoxy]-2,4-bis(2-methylbutan-2-yl)benzene Traditional Name: 2,4-ditert-amyl-1-[2-(N-diazonio-3-formyl-anilino)-2-keto-ethoxy]benzene Formula: C25H32N3O3+ MolecularWeight: 422.53988

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC(=C(C=C1)OCC(=O)N(C2=CC=CC(=C2)C=O)[N+]#N)C(C)(C)CC

Isomeric SMILES

CCC(C)(C)C1=CC(=C(C=C1)OCC(=O)N(C2=CC=CC(=C2)C=O)[N+]#N)C(C)(C)CC

InChI

InChI=1S/C25H32N3O3/c1-7-24(3,4)19-12-13-22(21(15-19)25(5,6)8-2)31-17-23(30)28(27-26)20-11-9-10-18(14-20)16-29/h9-16H,7-8,17H2,1-6H3/q+1