5-[(2E)-2-(3,5-ditert-butyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)hydrazinyl]-2-methyl-benzenesulfonic acid

Systemtic Name: 5-[(2E)-2-(3,5-ditert-butyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)hydrazinyl]-2-methyl-benzenesulfonic acid Openeye Name: 5-[(2E)-2-(3,5-ditert-butyl-6-oxo-cyclohexa-2,4-dien-1-ylidene)hydrazino]-2-methyl-benzenesulfonic acid CAS Name: 5-[(2E)-2-(3,5-ditert-butyl-6-oxo-1-cyclohexa-2,4-dienylidene)hydrazinyl]-2-methylbenzenesulfonic acid IUPAC Name: 5-[(2E)-2-(3,5-ditert-butyl-6-oxocyclohexa-2,4-dien-1-ylidene)hydrazinyl]-2-methylbenzenesulfonic acid Traditional Name: 5-[(N'E)-N'-(3,5-ditert-butyl-6-keto-cyclohexa-2,4-dien-1-ylidene)hydrazino]-2-methyl-besylic acid Formula: C21H28N2O4S MolecularWeight: 404.52302

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NN=C2C=C(C=C(C2=O)C(C)(C)C)C(C)(C)C)S(=O)(=O)O

Isomeric SMILES

CC1=C(C=C(C=C1)N/N=C/2\C=C(C=C(C2=O)C(C)(C)C)C(C)(C)C)S(=O)(=O)O

InChI

InChI=1S/C21H28N2O4S/c1-13-8-9-15(12-18(13)28(25,26)27)22-23-17-11-14(20(2,3)4)10-16(19(17)24)21(5,6)7/h8-12,22H,1-7H3,(H,25,26,27)/b23-17+