(2E)-2-[(3-nitrophenyl)methylidene]butanal

Systemtic Name: (2E)-2-[(3-nitrophenyl)methylidene]butanal Openeye Name: (2E)-2-[(3-nitrophenyl)methylene]butanal CAS Name: (2E)-2-[(3-nitrophenyl)methylidene]butanal IUPAC Name: (2E)-2-[(3-nitrophenyl)methylidene]butanal Traditional Name: (E)-2-ethyl-3-(3-nitrophenyl)acrolein Formula: C11H11NO3 MolecularWeight: 205.20994

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=CC1=CC(=CC=C1)[N+](=O)[O-])C=O

Isomeric SMILES

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

InChI

InChI=1S/C11H11NO3/c1-2-9(8-13)6-10-4-3-5-11(7-10)12(14)15/h3-8H,2H2,1H3/b9-6+