methyl 4-[(E)-2-nitroethenyl]benzenesulfonate

Systemtic Name: methyl 4-[(E)-2-nitroethenyl]benzenesulfonate Openeye Name: methyl 4-[(E)-2-nitrovinyl]benzenesulfonate CAS Name: 4-[(E)-2-nitroethenyl]benzenesulfonic acid methyl ester IUPAC Name: methyl 4-[(E)-2-nitroethenyl]benzenesulfonate Traditional Name: 4-[(E)-2-nitrovinyl]benzenesulfonic acid methyl ester Formula: C9H9NO5S MolecularWeight: 243.23646

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Descriptors Computed from Structure

Canonical SMILES:

COS(=O)(=O)C1=CC=C(C=C1)C=C[N+](=O)[O-]

Isomeric SMILES

COS(=O)(=O)C1=CC=C(C=C1)/C=C/[N+](=O)[O-]

InChI

InChI=1S/C9H9NO5S/c1-15-16(13,14)9-4-2-8(3-5-9)6-7-10(11)12/h2-7H,1H3/b7-6+