(E)-1-(5-chloranylthiophen-2-yl)-3-(3-nitro-4-oxidanyl-phenyl)prop-2-en-1-one

Systemtic Name: (E)-1-(5-chloranylthiophen-2-yl)-3-(3-nitro-4-oxidanyl-phenyl)prop-2-en-1-one Openeye Name: (E)-1-(5-chloro-2-thienyl)-3-(4-hydroxy-3-nitro-phenyl)prop-2-en-1-one CAS Name: (E)-1-(5-chloro-2-thiophenyl)-3-(4-hydroxy-3-nitrophenyl)-2-propen-1-one IUPAC Name: (E)-1-(5-chlorothiophen-2-yl)-3-(4-hydroxy-3-nitrophenyl)prop-2-en-1-one Traditional Name: (E)-1-(5-chloro-2-thienyl)-3-(4-hydroxy-3-nitro-phenyl)prop-2-en-1-one Formula: C13H8ClNO4S MolecularWeight: 309.72492

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C=CC(=O)C2=CC=C(S2)Cl)[N+](=O)[O-])O

Isomeric SMILES

C1=CC(=C(C=C1/C=C/C(=O)C2=CC=C(S2)Cl)[N+](=O)[O-])O

InChI

InChI=1S/C13H8ClNO4S/c14-13-6-5-12(20-13)11(17)4-2-8-1-3-10(16)9(7-8)15(18)19/h1-7,16H/b4-2+