1-(5-nitro-1-benzothiophen-2-yl)butan-1-one

Systemtic Name: 1-(5-nitro-1-benzothiophen-2-yl)butan-1-one Openeye Name: 1-(5-nitrobenzothiophen-2-yl)butan-1-one CAS Name: 1-(5-nitro-1-benzothiophen-2-yl)-1-butanone IUPAC Name: 1-(5-nitro-1-benzothiophen-2-yl)butan-1-one Traditional Name: 1-(5-nitrobenzothiophen-2-yl)butan-1-one Formula: C12H11NO3S MolecularWeight: 249.28564

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=CC2=C(S1)C=CC(=C2)[N+](=O)[O-]

Isomeric SMILES

CCCC(=O)C1=CC2=C(S1)C=CC(=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H11NO3S/c1-2-3-10(14)12-7-8-6-9(13(15)16)4-5-11(8)17-12/h4-7H,2-3H2,1H3