phenethyl 4-[[3-[(3-chloranyl-4-fluoranyl-phenyl)carbamoyl]phenyl]amino]-4-oxidanylidene-butanoate

Systemtic Name: phenethyl 4-[[3-[(3-chloranyl-4-fluoranyl-phenyl)carbamoyl]phenyl]amino]-4-oxidanylidene-butanoate Openeye Name: phenethyl 4-[3-[(3-chloro-4-fluoro-phenyl)carbamoyl]anilino]-4-oxo-butanoate CAS Name: 4-[3-[(3-chloro-4-fluoroanilino)-oxomethyl]anilino]-4-oxobutanoic acid phenethyl ester IUPAC Name: phenethyl 4-[3-[(3-chloro-4-fluorophenyl)carbamoyl]anilino]-4-oxobutanoate Traditional Name: 4-[3-[(3-chloro-4-fluoro-phenyl)carbamoyl]anilino]-4-keto-butyric acid phenethyl ester Formula: C25H22ClFN2O4 MolecularWeight: 468.904583

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCOC(=O)CCC(=O)NC2=CC=CC(=C2)C(=O)NC3=CC(=C(C=C3)F)Cl

Isomeric SMILES

C1=CC=C(C=C1)CCOC(=O)CCC(=O)NC2=CC=CC(=C2)C(=O)NC3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C25H22ClFN2O4/c26-21-16-20(9-10-22(21)27)29-25(32)18-7-4-8-19(15-18)28-23(30)11-12-24(31)33-14-13-17-5-2-1-3-6-17/h1-10,15-16H,11-14H2,(H,28,30)(H,29,32)