1,4-dimethoxy-2-[(E)-2-nitrobut-1-enyl]-5-propylsulfanyl-benzene

Systemtic Name: 1,4-dimethoxy-2-[(E)-2-nitrobut-1-enyl]-5-propylsulfanyl-benzene Openeye Name: 1,4-dimethoxy-2-[(E)-2-nitrobut-1-enyl]-5-propylsulfanyl-benzene CAS Name: 1,4-dimethoxy-2-[(E)-2-nitrobut-1-enyl]-5-(propylthio)benzene IUPAC Name: 1,4-dimethoxy-2-[(E)-2-nitrobut-1-enyl]-5-propylsulfanylbenzene Traditional Name: 1,4-dimethoxy-2-[(E)-2-nitrobut-1-enyl]-5-(propylthio)benzene Formula: C15H21NO4S MolecularWeight: 311.39654

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=C(C=C(C(=C1)OC)C=C(CC)[N+](=O)[O-])OC

Isomeric SMILES

CCCSC1=C(C=C(C(=C1)OC)/C=C(\CC)/[N+](=O)[O-])OC

InChI

InChI=1S/C15H21NO4S/c1-5-7-21-15-10-13(19-3)11(9-14(15)20-4)8-12(6-2)16(17)18/h8-10H,5-7H2,1-4H3/b12-8+