5-ethylsulfanyl-1,3-dimethoxy-2-[(E)-2-nitroprop-1-enyl]benzene

Systemtic Name: 5-ethylsulfanyl-1,3-dimethoxy-2-[(E)-2-nitroprop-1-enyl]benzene Openeye Name: 5-ethylsulfanyl-1,3-dimethoxy-2-[(E)-2-nitroprop-1-enyl]benzene CAS Name: 5-(ethylthio)-1,3-dimethoxy-2-[(E)-2-nitroprop-1-enyl]benzene IUPAC Name: 5-ethylsulfanyl-1,3-dimethoxy-2-[(E)-2-nitroprop-1-enyl]benzene Traditional Name: 5-(ethylthio)-1,3-dimethoxy-2-[(E)-2-nitroprop-1-enyl]benzene Formula: C13H17NO4S MolecularWeight: 283.34338

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC(=C(C(=C1)OC)C=C(C)[N+](=O)[O-])OC

Isomeric SMILES

CCSC1=CC(=C(C(=C1)OC)/C=C(\C)/[N+](=O)[O-])OC

InChI

InChI=1S/C13H17NO4S/c1-5-19-10-7-12(17-3)11(13(8-10)18-4)6-9(2)14(15)16/h6-8H,5H2,1-4H3/b9-6+