2-[(E)-2-nitropent-1-enyl]-1-benzothiophene

Systemtic Name: 2-[(E)-2-nitropent-1-enyl]-1-benzothiophene Openeye Name: 2-[(E)-2-nitropent-1-enyl]benzothiophene CAS Name: 2-[(E)-2-nitropent-1-enyl]-1-benzothiophene IUPAC Name: 2-[(E)-2-nitropent-1-enyl]-1-benzothiophene Traditional Name: 2-[(E)-2-nitropent-1-enyl]benzothiophene Formula: C13H13NO2S MolecularWeight: 247.31282

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=CC1=CC2=CC=CC=C2S1)[N+](=O)[O-]

Isomeric SMILES

CCC/C(=C\C1=CC2=CC=CC=C2S1)/[N+](=O)[O-]

InChI

InChI=1S/C13H13NO2S/c1-2-5-11(14(15)16)9-12-8-10-6-3-4-7-13(10)17-12/h3-4,6-9H,2,5H2,1H3/b11-9+