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

Systemtic Name: 3-[[4-chloranyl-1-(4-iodanyl-2-methyl-phenyl)-2,5-bis(oxidanylidene)pyrrol-3-yl]amino]benzoate Openeye Name: 3-[[4-chloro-1-(4-iodo-2-methyl-phenyl)-2,5-dioxo-pyrrol-3-yl]amino]benzoate CAS Name: 3-[[4-chloro-1-(4-iodo-2-methylphenyl)-2,5-dioxo-3-pyrrolyl]amino]benzoate IUPAC Name: 3-[[4-chloro-1-(4-iodo-2-methylphenyl)-2,5-dioxopyrrol-3-yl]amino]benzoate Traditional Name: 3-[[4-chloro-1-(4-iodo-2-methyl-phenyl)-2,5-diketo-3-pyrrolin-3-yl]amino]benzoate Formula: C18H11ClIN2O4- MolecularWeight: 481.64841

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)I)N2C(=O)C(=C(C2=O)Cl)NC3=CC=CC(=C3)C(=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)I)N2C(=O)C(=C(C2=O)Cl)NC3=CC=CC(=C3)C(=O)[O-]

InChI

InChI=1S/C18H12ClIN2O4/c1-9-7-11(20)5-6-13(9)22-16(23)14(19)15(17(22)24)21-12-4-2-3-10(8-12)18(25)26/h2-8,21H,1H3,(H,25,26)/p-1