(4-tert-butylphenyl)methyl-methyl-[2-oxidanylidene-2-[2-(phenylcarbonyl)hydrazinyl]ethyl]azanium

Systemtic Name: (4-tert-butylphenyl)methyl-methyl-[2-oxidanylidene-2-[2-(phenylcarbonyl)hydrazinyl]ethyl]azanium Openeye Name: [2-(2-benzoylhydrazino)-2-oxo-ethyl]-[(4-tert-butylphenyl)methyl]-methyl-ammonium CAS Name: [2-(benzoylhydrazo)-2-oxoethyl]-[(4-tert-butylphenyl)methyl]-methylammonium IUPAC Name: [2-(2-benzoylhydrazinyl)-2-oxoethyl]-[(4-tert-butylphenyl)methyl]-methylazanium Traditional Name: [2-(N'-benzoylhydrazino)-2-keto-ethyl]-(4-tert-butylbenzyl)-methyl-ammonium Formula: C21H28N3O2+ MolecularWeight: 354.46592

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C[NH+](C)CC(=O)NNC(=O)C2=CC=CC=C2

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C[NH+](C)CC(=O)NNC(=O)C2=CC=CC=C2

InChI

InChI=1S/C21H27N3O2/c1-21(2,3)18-12-10-16(11-13-18)14-24(4)15-19(25)22-23-20(26)17-8-6-5-7-9-17/h5-13H,14-15H2,1-4H3,(H,22,25)(H,23,26)/p+1