(2E)-2-[(7-chloranyl-1,3-benzodioxol-5-yl)methylidene]-N-(4-nitrophenyl)-3-oxidanylidene-butanamide

Systemtic Name: (2E)-2-[(7-chloranyl-1,3-benzodioxol-5-yl)methylidene]-N-(4-nitrophenyl)-3-oxidanylidene-butanamide Openeye Name: (2E)-2-[(7-chloro-1,3-benzodioxol-5-yl)methylene]-N-(4-nitrophenyl)-3-oxo-butanamide CAS Name: (2E)-2-[(7-chloro-1,3-benzodioxol-5-yl)methylidene]-N-(4-nitrophenyl)-3-oxobutanamide IUPAC Name: (2E)-2-[(7-chloro-1,3-benzodioxol-5-yl)methylidene]-N-(4-nitrophenyl)-3-oxobutanamide Traditional Name: (E)-2-acetyl-3-(7-chloro-1,3-benzodioxol-5-yl)-N-(4-nitrophenyl)acrylamide Formula: C18H13ClN2O6 MolecularWeight: 388.75862

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=CC1=CC2=C(C(=C1)Cl)OCO2)C(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(=O)/C(=C\C1=CC2=C(C(=C1)Cl)OCO2)/C(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H13ClN2O6/c1-10(22)14(6-11-7-15(19)17-16(8-11)26-9-27-17)18(23)20-12-2-4-13(5-3-12)21(24)25/h2-8H,9H2,1H3,(H,20,23)/b14-6+