3-[[(4-nitro-1H-pyrrol-2-yl)carbonylamino]carbamoyl]benzamide

Systemtic Name: 3-[[(4-nitro-1H-pyrrol-2-yl)carbonylamino]carbamoyl]benzamide Openeye Name: 3-[[(4-nitro-1H-pyrrole-2-carbonyl)amino]carbamoyl]benzamide CAS Name: 3-[[[(4-nitro-1H-pyrrol-2-yl)-oxomethyl]hydrazo]-oxomethyl]benzamide IUPAC Name: 3-[[(4-nitro-1H-pyrrole-2-carbonyl)amino]carbamoyl]benzamide Traditional Name: 3-[[(4-nitro-1H-pyrrole-2-carbonyl)amino]carbamoyl]benzamide Formula: C13H11N5O5 MolecularWeight: 317.25694

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(=O)NNC(=O)C2=CC(=CN2)[N+](=O)[O-])C(=O)N

Isomeric SMILES

C1=CC(=CC(=C1)C(=O)NNC(=O)C2=CC(=CN2)[N+](=O)[O-])C(=O)N

InChI

InChI=1S/C13H11N5O5/c14-11(19)7-2-1-3-8(4-7)12(20)16-17-13(21)10-5-9(6-15-10)18(22)23/h1-6,15H,(H2,14,19)(H,16,20)(H,17,21)