sodium; 2,6-bis(prop-2-enyl)phenol; N-(4-dimethylaminophenyl)iminosulfamate

Systemtic Name: sodium; 2,6-bis(prop-2-enyl)phenol; N-(4-dimethylaminophenyl)iminosulfamate Openeye Name: sodium; 2,6-diallylphenol; N-(4-dimethylaminophenyl)iminosulfamate CAS Name: sodium; 2,6-bis(prop-2-enyl)phenol; N-(4-dimethylaminophenyl)iminosulfamate IUPAC Name: sodium; 2,6-bis(prop-2-enyl)phenol; N-(4-dimethylaminophenyl)iminosulfamate Traditional Name: sodium; 2,6-diallylphenol; N-(4-dimethylaminophenyl)iminosulfamate Formula: C20H24N3NaO4S MolecularWeight: 425.47703

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)N=NS(=O)(=O)[O-].C=CCC1=C(C(=CC=C1)CC=C)O.[Na+]

Isomeric SMILES

CN(C)C1=CC=C(C=C1)N=NS(=O)(=O)[O-].C=CCC1=C(C(=CC=C1)CC=C)O.[Na+]

InChI

InChI=1S/C12H14O.C8H11N3O3S.Na/c1-3-6-10-8-5-9-11(7-4-2)12(10)13;1-11(2)8-5-3-7(4-6-8)9-10-15(12,13)14;/h3-5,8-9,13H,1-2,6-7H2;3-6H,1-2H3,(H,12,13,14);/q;;+1/p-1