3-[[4-chloranyl-1-(3-nitrophenyl)-2,5-bis(oxidanylidene)pyrrol-3-yl]amino]benzoate

Systemtic Name: 3-[[4-chloranyl-1-(3-nitrophenyl)-2,5-bis(oxidanylidene)pyrrol-3-yl]amino]benzoate Openeye Name: 3-[[4-chloro-1-(3-nitrophenyl)-2,5-dioxo-pyrrol-3-yl]amino]benzoate CAS Name: 3-[[4-chloro-1-(3-nitrophenyl)-2,5-dioxo-3-pyrrolyl]amino]benzoate IUPAC Name: 3-[[4-chloro-1-(3-nitrophenyl)-2,5-dioxopyrrol-3-yl]amino]benzoate Traditional Name: 3-[[4-chloro-2,5-diketo-1-(3-nitrophenyl)-3-pyrrolin-3-yl]amino]benzoate Formula: C17H9ClN3O6- MolecularWeight: 386.72286

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC2=C(C(=O)N(C2=O)C3=CC(=CC=C3)[N+](=O)[O-])Cl)C(=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)NC2=C(C(=O)N(C2=O)C3=CC(=CC=C3)[N+](=O)[O-])Cl)C(=O)[O-]

InChI

InChI=1S/C17H10ClN3O6/c18-13-14(19-10-4-1-3-9(7-10)17(24)25)16(23)20(15(13)22)11-5-2-6-12(8-11)21(26)27/h1-8,19H,(H,24,25)/p-1