N-(3,4-dihydro-2H-pyran-2-ylmethyl)-3,5-dinitro-benzamide

Systemtic Name: N-(3,4-dihydro-2H-pyran-2-ylmethyl)-3,5-dinitro-benzamide Openeye Name: N-(3,4-dihydro-2H-pyran-2-ylmethyl)-3,5-dinitro-benzamide CAS Name: N-(3,4-dihydro-2H-pyran-2-ylmethyl)-3,5-dinitrobenzamide IUPAC Name: N-(3,4-dihydro-2H-pyran-2-ylmethyl)-3,5-dinitrobenzamide Traditional Name: N-(3,4-dihydro-2H-pyran-2-ylmethyl)-3,5-dinitro-benzamide Formula: C13H13N3O6 MolecularWeight: 307.25882

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC=C1)CNC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1CC(OC=C1)CNC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H13N3O6/c17-13(14-8-12-3-1-2-4-22-12)9-5-10(15(18)19)7-11(6-9)16(20)21/h2,4-7,12H,1,3,8H2,(H,14,17)