[2-[(4-chloranyl-2-fluoranyl-phenyl)amino]-2-oxidanylidene-ethyl] (2S)-2-benzamidopropanoate

Systemtic Name: [2-[(4-chloranyl-2-fluoranyl-phenyl)amino]-2-oxidanylidene-ethyl] (2S)-2-benzamidopropanoate Openeye Name: [2-(4-chloro-2-fluoro-anilino)-2-oxo-ethyl] (2S)-2-benzamidopropanoate CAS Name: (2S)-2-benzamidopropanoic acid [2-(4-chloro-2-fluoroanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-chloro-2-fluoroanilino)-2-oxoethyl] (2S)-2-benzamidopropanoate Traditional Name: (2S)-2-benzamidopropionic acid [2-(4-chloro-2-fluoro-anilino)-2-keto-ethyl] ester Formula: C18H16ClFN2O4 MolecularWeight: 378.782043

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC(=O)NC1=C(C=C(C=C1)Cl)F)NC(=O)C2=CC=CC=C2

Isomeric SMILES

C[C@@H](C(=O)OCC(=O)NC1=C(C=C(C=C1)Cl)F)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C18H16ClFN2O4/c1-11(21-17(24)12-5-3-2-4-6-12)18(25)26-10-16(23)22-15-8-7-13(19)9-14(15)20/h2-9,11H,10H2,1H3,(H,21,24)(H,22,23)/t11-/m0/s1