(E)-1-diazonio-1-(3,6-dimethylnaphthalen-2-yl)sulfonyl-3,3-dimethyl-but-1-en-2-olate

Systemtic Name: (E)-1-diazonio-1-(3,6-dimethylnaphthalen-2-yl)sulfonyl-3,3-dimethyl-but-1-en-2-olate Openeye Name: (E)-1-diazonio-1-[(3,6-dimethyl-2-naphthyl)sulfonyl]-3,3-dimethyl-but-1-en-2-olate CAS Name: (E)-1-diazonio-1-[(3,6-dimethyl-2-naphthalenyl)sulfonyl]-3,3-dimethyl-1-buten-2-olate IUPAC Name: (E)-1-diazonio-1-(3,6-dimethylnaphthalen-2-yl)sulfonyl-3,3-dimethylbut-1-en-2-olate Traditional Name: (E)-1-diazonio-1-[(3,6-dimethyl-2-naphthyl)sulfonyl]-3,3-dimethyl-but-1-en-2-olate Formula: C18H20N2O3S MolecularWeight: 344.428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC(=C(C=C2C=C1)S(=O)(=O)C(=C(C(C)(C)C)[O-])[N+]#N)C

Isomeric SMILES

CC1=CC2=CC(=C(C=C2C=C1)S(=O)(=O)/C(=C(\C(C)(C)C)/[O-])/[N+]#N)C

InChI

InChI=1S/C18H20N2O3S/c1-11-6-7-13-10-15(12(2)9-14(13)8-11)24(22,23)17(20-19)16(21)18(3,4)5/h6-10H,1-5H3/b17-16+