1,3-dimethoxy-2-[(E)-2-nitroethenyl]-5-propan-2-ylsulfanyl-benzene

Systemtic Name: 1,3-dimethoxy-2-[(E)-2-nitroethenyl]-5-propan-2-ylsulfanyl-benzene Openeye Name: 5-isopropylsulfanyl-1,3-dimethoxy-2-[(E)-2-nitrovinyl]benzene CAS Name: 1,3-dimethoxy-2-[(E)-2-nitroethenyl]-5-(propan-2-ylthio)benzene IUPAC Name: 1,3-dimethoxy-2-[(E)-2-nitroethenyl]-5-propan-2-ylsulfanylbenzene Traditional Name: 5-(isopropylthio)-1,3-dimethoxy-2-[(E)-2-nitrovinyl]benzene Formula: C13H17NO4S MolecularWeight: 283.34338

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=CC(=C(C(=C1)OC)C=C[N+](=O)[O-])OC

Isomeric SMILES

CC(C)SC1=CC(=C(C(=C1)OC)/C=C/[N+](=O)[O-])OC

InChI

InChI=1S/C13H17NO4S/c1-9(2)19-10-7-12(17-3)11(5-6-14(15)16)13(8-10)18-4/h5-9H,1-4H3/b6-5+