3-chloranylpropyl (2E)-2-[(3-nitrophenyl)methylidene]-3-oxidanylidene-butanoate

Systemtic Name: 3-chloranylpropyl (2E)-2-[(3-nitrophenyl)methylidene]-3-oxidanylidene-butanoate Openeye Name: 3-chloropropyl (2E)-2-[(3-nitrophenyl)methylene]-3-oxo-butanoate CAS Name: (2E)-2-[(3-nitrophenyl)methylidene]-3-oxobutanoic acid 3-chloropropyl ester IUPAC Name: 3-chloropropyl (2E)-2-[(3-nitrophenyl)methylidene]-3-oxobutanoate Traditional Name: (E)-2-acetyl-3-(3-nitrophenyl)acrylic acid 3-chloropropyl ester Formula: C14H14ClNO5 MolecularWeight: 311.71766

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H14ClNO5/c1-10(17)13(14(18)21-7-3-6-15)9-11-4-2-5-12(8-11)16(19)20/h2,4-5,8-9H,3,6-7H2,1H3/b13-9+