[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl] 2-[(2-fluorophenyl)carbonylamino]-3-methyl-butanoate

Systemtic Name: [2-(4-methoxyphenyl)-2-oxidanylidene-ethyl] 2-[(2-fluorophenyl)carbonylamino]-3-methyl-butanoate Openeye Name: [2-(4-methoxyphenyl)-2-oxo-ethyl] 2-[(2-fluorobenzoyl)amino]-3-methyl-butanoate CAS Name: 2-[[(2-fluorophenyl)-oxomethyl]amino]-3-methylbutanoic acid [2-(4-methoxyphenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-methoxyphenyl)-2-oxoethyl] 2-[(2-fluorobenzoyl)amino]-3-methylbutanoate Traditional Name: 2-[(2-fluorobenzoyl)amino]-3-methyl-butyric acid [2-keto-2-(4-methoxyphenyl)ethyl] ester Formula: C21H22FNO5 MolecularWeight: 387.401483

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC(=O)C1=CC=C(C=C1)OC)NC(=O)C2=CC=CC=C2F

Isomeric SMILES

CC(C)C(C(=O)OCC(=O)C1=CC=C(C=C1)OC)NC(=O)C2=CC=CC=C2F

InChI

InChI=1S/C21H22FNO5/c1-13(2)19(23-20(25)16-6-4-5-7-17(16)22)21(26)28-12-18(24)14-8-10-15(27-3)11-9-14/h4-11,13,19H,12H2,1-3H3,(H,23,25)