4,5-bis(bromanyl)-1-methyl-N-[2-(4-nitrophenyl)-2-oxidanyl-ethyl]pyrrole-2-carboxamide

Systemtic Name: 4,5-bis(bromanyl)-1-methyl-N-[2-(4-nitrophenyl)-2-oxidanyl-ethyl]pyrrole-2-carboxamide Openeye Name: 4,5-dibromo-N-[2-hydroxy-2-(4-nitrophenyl)ethyl]-1-methyl-pyrrole-2-carboxamide CAS Name: 4,5-dibromo-N-[2-hydroxy-2-(4-nitrophenyl)ethyl]-1-methyl-2-pyrrolecarboxamide IUPAC Name: 4,5-dibromo-N-[2-hydroxy-2-(4-nitrophenyl)ethyl]-1-methylpyrrole-2-carboxamide Traditional Name: 4,5-dibromo-N-[2-hydroxy-2-(4-nitrophenyl)ethyl]-1-methyl-pyrrole-2-carboxamide Formula: C14H13Br2N3O4 MolecularWeight: 447.07872

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=C1Br)Br)C(=O)NCC(C2=CC=C(C=C2)[N+](=O)[O-])O

Isomeric SMILES

CN1C(=CC(=C1Br)Br)C(=O)NCC(C2=CC=C(C=C2)[N+](=O)[O-])O

InChI

InChI=1S/C14H13Br2N3O4/c1-18-11(6-10(15)13(18)16)14(21)17-7-12(20)8-2-4-9(5-3-8)19(22)23/h2-6,12,20H,7H2,1H3,(H,17,21)