3-[(4-chloranyl-2-fluoranyl-phenyl)carbonylamino]-2-(4-methoxyphenyl)-2-propoxy-butanoic acid

Systemtic Name: 3-[(4-chloranyl-2-fluoranyl-phenyl)carbonylamino]-2-(4-methoxyphenyl)-2-propoxy-butanoic acid Openeye Name: 3-[(4-chloro-2-fluoro-benzoyl)amino]-2-(4-methoxyphenyl)-2-propoxy-butanoic acid CAS Name: 3-[[(4-chloro-2-fluorophenyl)-oxomethyl]amino]-2-(4-methoxyphenyl)-2-propoxybutanoic acid IUPAC Name: 3-[(4-chloro-2-fluorobenzoyl)amino]-2-(4-methoxyphenyl)-2-propoxybutanoic acid Traditional Name: 3-[(4-chloro-2-fluoro-benzoyl)amino]-2-(4-methoxyphenyl)-2-propoxy-butyric acid Formula: C21H23ClFNO5 MolecularWeight: 423.862423

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(C1=CC=C(C=C1)OC)(C(C)NC(=O)C2=C(C=C(C=C2)Cl)F)C(=O)O

Isomeric SMILES

CCCOC(C1=CC=C(C=C1)OC)(C(C)NC(=O)C2=C(C=C(C=C2)Cl)F)C(=O)O

InChI

InChI=1S/C21H23ClFNO5/c1-4-11-29-21(20(26)27,14-5-8-16(28-3)9-6-14)13(2)24-19(25)17-10-7-15(22)12-18(17)23/h5-10,12-13H,4,11H2,1-3H3,(H,24,25)(H,26,27)