N-methyl-3,4-dinitro-N-prop-2-ynyl-benzamide

Systemtic Name: N-methyl-3,4-dinitro-N-prop-2-ynyl-benzamide Openeye Name: N-methyl-3,4-dinitro-N-prop-2-ynyl-benzamide CAS Name: N-methyl-3,4-dinitro-N-prop-2-ynylbenzamide IUPAC Name: N-methyl-3,4-dinitro-N-prop-2-ynylbenzamide Traditional Name: N-methyl-3,4-dinitro-N-propargyl-benzamide Formula: C11H9N3O5 MolecularWeight: 263.20626

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC#C)C(=O)C1=CC(=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CN(CC#C)C(=O)C1=CC(=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C11H9N3O5/c1-3-6-12(2)11(15)8-4-5-9(13(16)17)10(7-8)14(18)19/h1,4-5,7H,6H2,2H3