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

Systemtic Name: (E)-3-(5-nitro-2-oxidanyl-phenyl)prop-2-enal Openeye Name: (E)-3-(2-hydroxy-5-nitro-phenyl)prop-2-enal CAS Name: (E)-3-(2-hydroxy-5-nitrophenyl)-2-propenal IUPAC Name: (E)-3-(2-hydroxy-5-nitrophenyl)prop-2-enal Traditional Name: (E)-3-(2-hydroxy-5-nitro-phenyl)acrolein Formula: C9H7NO4 MolecularWeight: 193.15618

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H7NO4/c11-5-1-2-7-6-8(10(13)14)3-4-9(7)12/h1-6,12H/b2-1+