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

Systemtic Name: [4-(4-fluorophenyl)-4-oxidanylidene-butyl] (2S)-2-[(4-methoxyphenyl)carbonylamino]-3-methyl-butanoate Openeye Name: [4-(4-fluorophenyl)-4-oxo-butyl] (2S)-2-[(4-methoxybenzoyl)amino]-3-methyl-butanoate CAS Name: (2S)-2-[[(4-methoxyphenyl)-oxomethyl]amino]-3-methylbutanoic acid [4-(4-fluorophenyl)-4-oxobutyl] ester IUPAC Name: [4-(4-fluorophenyl)-4-oxobutyl] (2S)-2-[(4-methoxybenzoyl)amino]-3-methylbutanoate Traditional Name: (2S)-3-methyl-2-(p-anisoylamino)butyric acid [4-(4-fluorophenyl)-4-keto-butyl] ester Formula: C23H26FNO5 MolecularWeight: 415.454643

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCCCC(=O)C1=CC=C(C=C1)F)NC(=O)C2=CC=C(C=C2)OC

Isomeric SMILES

CC(C)[C@@H](C(=O)OCCCC(=O)C1=CC=C(C=C1)F)NC(=O)C2=CC=C(C=C2)OC

InChI

InChI=1S/C23H26FNO5/c1-15(2)21(25-22(27)17-8-12-19(29-3)13-9-17)23(28)30-14-4-5-20(26)16-6-10-18(24)11-7-16/h6-13,15,21H,4-5,14H2,1-3H3,(H,25,27)/t21-/m0/s1