1-methoxy-5-methyl-4-methylsulfanyl-2-[(E)-2-nitroprop-1-enyl]benzene

Systemtic Name: 1-methoxy-5-methyl-4-methylsulfanyl-2-[(E)-2-nitroprop-1-enyl]benzene Openeye Name: 1-methoxy-5-methyl-4-methylsulfanyl-2-[(E)-2-nitroprop-1-enyl]benzene CAS Name: 1-methoxy-5-methyl-4-(methylthio)-2-[(E)-2-nitroprop-1-enyl]benzene IUPAC Name: 1-methoxy-5-methyl-4-methylsulfanyl-2-[(E)-2-nitroprop-1-enyl]benzene Traditional Name: 1-methoxy-5-methyl-4-(methylthio)-2-[(E)-2-nitroprop-1-enyl]benzene Formula: C12H15NO3S MolecularWeight: 253.3174

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=C(C=C(C(=C1)OC)/C=C(\C)/[N+](=O)[O-])SC

InChI

InChI=1S/C12H15NO3S/c1-8-5-11(16-3)10(7-12(8)17-4)6-9(2)13(14)15/h5-7H,1-4H3/b9-6+