N-(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)-1-methyl-4-nitro-pyrrole-2-carboxamide

Systemtic Name: N-(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)-1-methyl-4-nitro-pyrrole-2-carboxamide Openeye Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-1-methyl-4-nitro-pyrrole-2-carboxamide CAS Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-1-methyl-4-nitro-2-pyrrolecarboxamide IUPAC Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-1-methyl-4-nitropyrrole-2-carboxamide Traditional Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-1-methyl-4-nitro-pyrrole-2-carboxamide Formula: C14H12BrN3O5 MolecularWeight: 382.16618

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)NC2=CC3=C(C=C2Br)OCCO3)[N+](=O)[O-]

Isomeric SMILES

CN1C=C(C=C1C(=O)NC2=CC3=C(C=C2Br)OCCO3)[N+](=O)[O-]

InChI

InChI=1S/C14H12BrN3O5/c1-17-7-8(18(20)21)4-11(17)14(19)16-10-6-13-12(5-9(10)15)22-2-3-23-13/h4-7H,2-3H2,1H3,(H,16,19)