3-[(Z)-(1-aminocarbonyl-6-chloranyl-5-fluoranyl-2-oxidanylidene-indol-3-ylidene)-thiophen-2-yl-methoxy]carbonylbenzoic acid

Systemtic Name: 3-[(Z)-(1-aminocarbonyl-6-chloranyl-5-fluoranyl-2-oxidanylidene-indol-3-ylidene)-thiophen-2-yl-methoxy]carbonylbenzoic acid Openeye Name: 3-[(Z)-(1-carbamoyl-6-chloro-5-fluoro-2-oxo-indolin-3-ylidene)-(2-thienyl)methoxy]carbonylbenzoic acid CAS Name: 3-[[(Z)-(1-carbamoyl-6-chloro-5-fluoro-2-oxo-3-indolylidene)-thiophen-2-ylmethoxy]-oxomethyl]benzoic acid IUPAC Name: 3-[(Z)-(1-carbamoyl-6-chloro-5-fluoro-2-oxoindol-3-ylidene)-thiophen-2-ylmethoxy]carbonylbenzoic acid Traditional Name: 3-[(Z)-(1-carbamoyl-6-chloro-5-fluoro-2-keto-indolin-3-ylidene)-(2-thienyl)methoxy]carbonylbenzoic acid Formula: C22H12ClFN2O6S MolecularWeight: 486.856883

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(=O)OC(=C2C3=CC(=C(C=C3N(C2=O)C(=O)N)Cl)F)C4=CC=CS4)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)C(=O)O/C(=C\2/C3=CC(=C(C=C3N(C2=O)C(=O)N)Cl)F)/C4=CC=CS4)C(=O)O

InChI

InChI=1S/C22H12ClFN2O6S/c23-13-9-15-12(8-14(13)24)17(19(27)26(15)22(25)31)18(16-5-2-6-33-16)32-21(30)11-4-1-3-10(7-11)20(28)29/h1-9H,(H2,25,31)(H,28,29)/b18-17-