(E)-3-(5-chloranyl-3-nitro-2-oxidanyl-phenyl)-2-methyl-prop-2-enal

Systemtic Name: (E)-3-(5-chloranyl-3-nitro-2-oxidanyl-phenyl)-2-methyl-prop-2-enal Openeye Name: (E)-3-(5-chloro-2-hydroxy-3-nitro-phenyl)-2-methyl-prop-2-enal CAS Name: (E)-3-(5-chloro-2-hydroxy-3-nitrophenyl)-2-methyl-2-propenal IUPAC Name: (E)-3-(5-chloro-2-hydroxy-3-nitrophenyl)-2-methylprop-2-enal Traditional Name: (E)-3-(5-chloro-2-hydroxy-3-nitro-phenyl)-2-methyl-acrolein Formula: C10H8ClNO4 MolecularWeight: 241.62782

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1=CC(=CC(=C1O)[N+](=O)[O-])Cl)C=O

Isomeric SMILES

C/C(=C\C1=CC(=CC(=C1O)[N+](=O)[O-])Cl)/C=O

InChI

InChI=1S/C10H8ClNO4/c1-6(5-13)2-7-3-8(11)4-9(10(7)14)12(15)16/h2-5,14H,1H3/b6-2+