(E)-1-diazonio-3-[(3S,6S)-6-phenyl-3,6-dihydro-1,2-dioxin-3-yl]prop-1-en-2-olate

Systemtic Name: (E)-1-diazonio-3-[(3S,6S)-6-phenyl-3,6-dihydro-1,2-dioxin-3-yl]prop-1-en-2-olate Openeye Name: (E)-1-diazonio-3-[(3S,6S)-6-phenyl-3,6-dihydro-1,2-dioxin-3-yl]prop-1-en-2-olate CAS Name: (E)-1-diazonio-3-[(3S,6S)-6-phenyl-3,6-dihydro-1,2-dioxin-3-yl]-1-propen-2-olate IUPAC Name: (E)-1-diazonio-3-[(3S,6S)-6-phenyl-3,6-dihydro-1,2-dioxin-3-yl]prop-1-en-2-olate Traditional Name: (E)-1-diazonio-3-[(3S,6S)-6-phenyl-3,6-dihydro-o-dioxin-3-yl]prop-1-en-2-olate Formula: C13H12N2O3 MolecularWeight: 244.24598

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2C=CC(OO2)CC(=C[N+]#N)[O-]

Isomeric SMILES

C1=CC=C(C=C1)[C@@H]2C=C[C@@H](OO2)C/C(=C\[N+]#N)/[O-]

InChI

InChI=1S/C13H12N2O3/c14-15-9-11(16)8-12-6-7-13(18-17-12)10-4-2-1-3-5-10/h1-7,9,12-13H,8H2/b11-9+/t12-,13+/m1/s1