(E)-5-nitro-6-thiophen-2-yl-hex-5-en-2-one

Systemtic Name: (E)-5-nitro-6-thiophen-2-yl-hex-5-en-2-one Openeye Name: (E)-5-nitro-6-(2-thienyl)hex-5-en-2-one CAS Name: (E)-5-nitro-6-thiophen-2-yl-5-hexen-2-one IUPAC Name: (E)-5-nitro-6-thiophen-2-ylhex-5-en-2-one Traditional Name: (E)-5-nitro-6-(2-thienyl)hex-5-en-2-one Formula: C10H11NO3S MolecularWeight: 225.26424

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCC(=CC1=CC=CS1)[N+](=O)[O-]

Isomeric SMILES

CC(=O)CC/C(=C\C1=CC=CS1)/[N+](=O)[O-]

InChI

InChI=1S/C10H11NO3S/c1-8(12)4-5-9(11(13)14)7-10-3-2-6-15-10/h2-3,6-7H,4-5H2,1H3/b9-7+