4-[[4-chloranyl-2,5-bis(oxidanylidene)-1-phenethyl-pyrrol-3-yl]amino]benzoic acid

Systemtic Name: 4-[[4-chloranyl-2,5-bis(oxidanylidene)-1-phenethyl-pyrrol-3-yl]amino]benzoic acid Openeye Name: 4-[(4-chloro-2,5-dioxo-1-phenethyl-pyrrol-3-yl)amino]benzoic acid CAS Name: 4-[(4-chloro-2,5-dioxo-1-phenethyl-3-pyrrolyl)amino]benzoic acid IUPAC Name: 4-[(4-chloro-2,5-dioxo-1-phenethylpyrrol-3-yl)amino]benzoic acid Traditional Name: 4-[(4-chloro-2,5-diketo-1-phenethyl-3-pyrrolin-3-yl)amino]benzoic acid Formula: C19H15ClN2O4 MolecularWeight: 370.7864

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN2C(=O)C(=C(C2=O)Cl)NC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CCN2C(=O)C(=C(C2=O)Cl)NC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C19H15ClN2O4/c20-15-16(21-14-8-6-13(7-9-14)19(25)26)18(24)22(17(15)23)11-10-12-4-2-1-3-5-12/h1-9,21H,10-11H2,(H,25,26)