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

Systemtic Name: 1-methoxy-2-methyl-4-methylsulfanyl-5-[(E)-2-nitroprop-1-enyl]benzene Openeye Name: 1-methoxy-2-methyl-4-methylsulfanyl-5-[(E)-2-nitroprop-1-enyl]benzene CAS Name: 1-methoxy-2-methyl-4-(methylthio)-5-[(E)-2-nitroprop-1-enyl]benzene IUPAC Name: 1-methoxy-2-methyl-4-methylsulfanyl-5-[(E)-2-nitroprop-1-enyl]benzene Traditional Name: 1-methoxy-2-methyl-4-(methylthio)-5-[(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)SC)C=C(C)[N+](=O)[O-])OC

Isomeric SMILES

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

InChI

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