4-chloranyl-3-[(4-nitro-1H-pyrrol-2-yl)carbonylamino]benzoic acid

Systemtic Name: 4-chloranyl-3-[(4-nitro-1H-pyrrol-2-yl)carbonylamino]benzoic acid Openeye Name: 4-chloro-3-[(4-nitro-1H-pyrrole-2-carbonyl)amino]benzoic acid CAS Name: 4-chloro-3-[[(4-nitro-1H-pyrrol-2-yl)-oxomethyl]amino]benzoic acid IUPAC Name: 4-chloro-3-[(4-nitro-1H-pyrrole-2-carbonyl)amino]benzoic acid Traditional Name: 4-chloro-3-[(4-nitro-1H-pyrrole-2-carbonyl)amino]benzoic acid Formula: C12H8ClN3O5 MolecularWeight: 309.66202

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)O)NC(=O)C2=CC(=CN2)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=C(C=C1C(=O)O)NC(=O)C2=CC(=CN2)[N+](=O)[O-])Cl

InChI

InChI=1S/C12H8ClN3O5/c13-8-2-1-6(12(18)19)3-9(8)15-11(17)10-4-7(5-14-10)16(20)21/h1-5,14H,(H,15,17)(H,18,19)