(E)-2-diazonio-1-[(2R,4S)-4-(4-methylphenoxy)pentan-2-yl]oxy-ethenolate

Systemtic Name: (E)-2-diazonio-1-[(2R,4S)-4-(4-methylphenoxy)pentan-2-yl]oxy-ethenolate Openeye Name: (E)-2-diazonio-1-[(1R,3S)-1-methyl-3-(4-methylphenoxy)butoxy]ethenolate CAS Name: (E)-2-diazonio-1-[(2R,4S)-4-(4-methylphenoxy)pentan-2-yl]oxyethenolate IUPAC Name: (E)-2-diazonio-1-[(2R,4S)-4-(4-methylphenoxy)pentan-2-yl]oxyethenolate Traditional Name: (E)-2-diazonio-1-[(1R,3S)-1-methyl-3-(4-methylphenoxy)butoxy]ethenolate Formula: C14H18N2O3 MolecularWeight: 262.30432

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OC(C)CC(C)OC(=C[N+]#N)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)O[C@@H](C)C[C@@H](C)O/C(=C/[N+]#N)/[O-]

InChI

InChI=1S/C14H18N2O3/c1-10-4-6-13(7-5-10)18-11(2)8-12(3)19-14(17)9-16-15/h4-7,9,11-12H,8H2,1-3H3/b14-9+/t11-,12+/m0/s1