1-[4-nitro-5-(prop-2-ynylamino)thiophen-2-yl]ethanone

Systemtic Name: 1-[4-nitro-5-(prop-2-ynylamino)thiophen-2-yl]ethanone Openeye Name: 1-[4-nitro-5-(prop-2-ynylamino)-2-thienyl]ethanone CAS Name: 1-[4-nitro-5-(prop-2-ynylamino)-2-thiophenyl]ethanone IUPAC Name: 1-[4-nitro-5-(prop-2-ynylamino)thiophen-2-yl]ethanone Traditional Name: 1-[4-nitro-5-(propargylamino)-2-thienyl]ethanone Formula: C9H8N2O3S MolecularWeight: 224.23642

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(S1)NCC#C)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C1=CC(=C(S1)NCC#C)[N+](=O)[O-]

InChI

InChI=1S/C9H8N2O3S/c1-3-4-10-9-7(11(13)14)5-8(15-9)6(2)12/h1,5,10H,4H2,2H3