(E)-3-(nitromethyl)-5-phenyl-1-thiophen-2-yl-pent-4-en-1-one

Systemtic Name: (E)-3-(nitromethyl)-5-phenyl-1-thiophen-2-yl-pent-4-en-1-one Openeye Name: (E)-3-(nitromethyl)-5-phenyl-1-(2-thienyl)pent-4-en-1-one CAS Name: (E)-3-(nitromethyl)-5-phenyl-1-thiophen-2-yl-4-penten-1-one IUPAC Name: (E)-3-(nitromethyl)-5-phenyl-1-thiophen-2-ylpent-4-en-1-one Traditional Name: (E)-3-(nitromethyl)-5-phenyl-1-(2-thienyl)pent-4-en-1-one Formula: C16H15NO3S MolecularWeight: 301.3602

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CC(CC(=O)C2=CC=CS2)C[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)/C=C/C(CC(=O)C2=CC=CS2)C[N+](=O)[O-]

InChI

InChI=1S/C16H15NO3S/c18-15(16-7-4-10-21-16)11-14(12-17(19)20)9-8-13-5-2-1-3-6-13/h1-10,14H,11-12H2/b9-8+