2-chloranyl-N-(6-ethanoyl-1,3-benzodioxol-5-yl)-4-nitro-benzamide

Systemtic Name: 2-chloranyl-N-(6-ethanoyl-1,3-benzodioxol-5-yl)-4-nitro-benzamide Openeye Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-chloro-4-nitro-benzamide CAS Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-chloro-4-nitrobenzamide IUPAC Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-chloro-4-nitrobenzamide Traditional Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-chloro-4-nitro-benzamide Formula: C16H11ClN2O6 MolecularWeight: 362.72134

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1NC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])Cl)OCO2

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1NC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])Cl)OCO2

InChI

InChI=1S/C16H11ClN2O6/c1-8(20)11-5-14-15(25-7-24-14)6-13(11)18-16(21)10-3-2-9(19(22)23)4-12(10)17/h2-6H,7H2,1H3,(H,18,21)