azanium (E)-3-phenylsulfanylprop-2-enoate

Systemtic Name: azanium (E)-3-phenylsulfanylprop-2-enoate Openeye Name: ammonium (E)-3-phenylsulfanylprop-2-enoate CAS Name: ammonium (E)-3-(phenylthio)-2-propenoate IUPAC Name: azanium (E)-3-phenylsulfanylprop-2-enoate Traditional Name: ammonium (E)-3-(phenylthio)acrylate Formula: C9H11NO2S MolecularWeight: 197.25414

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC=CC(=O)[O-].[NH4+]

Isomeric SMILES

C1=CC=C(C=C1)S/C=C/C(=O)[O-].[NH4+]

InChI

InChI=1S/C9H8O2S.H3N/c10-9(11)6-7-12-8-4-2-1-3-5-8;/h1-7H,(H,10,11);1H3/b7-6+;