N-[5-tert-butyl-2-(trichloromethyl)-1,3-benzodioxol-2-yl]-3-nitro-benzamide

Systemtic Name: N-[5-tert-butyl-2-(trichloromethyl)-1,3-benzodioxol-2-yl]-3-nitro-benzamide Openeye Name: N-[5-tert-butyl-2-(trichloromethyl)-1,3-benzodioxol-2-yl]-3-nitro-benzamide CAS Name: N-[5-tert-butyl-2-(trichloromethyl)-1,3-benzodioxol-2-yl]-3-nitrobenzamide IUPAC Name: N-[5-tert-butyl-2-(trichloromethyl)-1,3-benzodioxol-2-yl]-3-nitrobenzamide Traditional Name: N-[5-tert-butyl-2-(trichloromethyl)-1,3-benzodioxol-2-yl]-3-nitro-benzamide Formula: C19H17Cl3N2O5 MolecularWeight: 459.70768

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC2=C(C=C1)OC(O2)(C(Cl)(Cl)Cl)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC2=C(C=C1)OC(O2)(C(Cl)(Cl)Cl)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H17Cl3N2O5/c1-17(2,3)12-7-8-14-15(10-12)29-19(28-14,18(20,21)22)23-16(25)11-5-4-6-13(9-11)24(26)27/h4-10H,1-3H3,(H,23,25)