N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2,4-dinitro-benzamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2,4-dinitro-benzamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2,4-dinitro-benzamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2,4-dinitrobenzamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2,4-dinitrobenzamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2,4-dinitro-benzamide Formula: C16H13N3O7 MolecularWeight: 359.29032

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C2O1)CNC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1C(OC2=CC=CC=C2O1)CNC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C16H13N3O7/c20-16(12-6-5-10(18(21)22)7-13(12)19(23)24)17-8-11-9-25-14-3-1-2-4-15(14)26-11/h1-7,11H,8-9H2,(H,17,20)