methyl 4-[[(2S)-3-methyl-2-(2-phenoxyethanoylamino)butanoyl]oxymethyl]benzoate

Systemtic Name: methyl 4-[[(2S)-3-methyl-2-(2-phenoxyethanoylamino)butanoyl]oxymethyl]benzoate Openeye Name: methyl 4-[[(2S)-3-methyl-2-[(2-phenoxyacetyl)amino]butanoyl]oxymethyl]benzoate CAS Name: 4-[[(2S)-3-methyl-1-oxo-2-[(1-oxo-2-phenoxyethyl)amino]butoxy]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[(2S)-3-methyl-2-[(2-phenoxyacetyl)amino]butanoyl]oxymethyl]benzoate Traditional Name: 4-[[(2S)-3-methyl-2-[(2-phenoxyacetyl)amino]butanoyl]oxymethyl]benzoic acid methyl ester Formula: C22H25NO6 MolecularWeight: 399.437

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC1=CC=C(C=C1)C(=O)OC)NC(=O)COC2=CC=CC=C2

Isomeric SMILES

CC(C)[C@@H](C(=O)OCC1=CC=C(C=C1)C(=O)OC)NC(=O)COC2=CC=CC=C2

InChI

InChI=1S/C22H25NO6/c1-15(2)20(23-19(24)14-28-18-7-5-4-6-8-18)22(26)29-13-16-9-11-17(12-10-16)21(25)27-3/h4-12,15,20H,13-14H2,1-3H3,(H,23,24)/t20-/m0/s1