4-[[3-[(3-chloranyl-4-fluoranyl-phenyl)carbamoyl]phenyl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[3-[(3-chloranyl-4-fluoranyl-phenyl)carbamoyl]phenyl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[3-[(3-chloro-4-fluoro-phenyl)carbamoyl]anilino]-4-oxo-butanoic acid CAS Name: 4-[3-[(3-chloro-4-fluoroanilino)-oxomethyl]anilino]-4-oxobutanoic acid IUPAC Name: 4-[3-[(3-chloro-4-fluorophenyl)carbamoyl]anilino]-4-oxobutanoic acid Traditional Name: 4-[3-[(3-chloro-4-fluoro-phenyl)carbamoyl]anilino]-4-keto-butyric acid Formula: C17H14ClFN2O4 MolecularWeight: 364.755463

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)CCC(=O)O)C(=O)NC2=CC(=C(C=C2)F)Cl

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)CCC(=O)O)C(=O)NC2=CC(=C(C=C2)F)Cl

InChI

InChI=1S/C17H14ClFN2O4/c18-13-9-12(4-5-14(13)19)21-17(25)10-2-1-3-11(8-10)20-15(22)6-7-16(23)24/h1-5,8-9H,6-7H2,(H,20,22)(H,21,25)(H,23,24)