2-methyl-3,5-dinitro-N-propan-2-yl-benzamide

Systemtic Name: 2-methyl-3,5-dinitro-N-propan-2-yl-benzamide Openeye Name: N-isopropyl-2-methyl-3,5-dinitro-benzamide CAS Name: 2-methyl-3,5-dinitro-N-propan-2-ylbenzamide IUPAC Name: 2-methyl-3,5-dinitro-N-propan-2-ylbenzamide Traditional Name: N-isopropyl-2-methyl-3,5-dinitro-benzamide Formula: C11H13N3O5 MolecularWeight: 267.23802

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1C(=O)NC(C)C)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1C(=O)NC(C)C)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C11H13N3O5/c1-6(2)12-11(15)9-4-8(13(16)17)5-10(7(9)3)14(18)19/h4-6H,1-3H3,(H,12,15)