2-[(2S)-3-methyl-2-[(4-methylphenyl)carbonylamino]butanoyl]oxyethyl benzoate

Systemtic Name: 2-[(2S)-3-methyl-2-[(4-methylphenyl)carbonylamino]butanoyl]oxyethyl benzoate Openeye Name: 2-[(2S)-3-methyl-2-[(4-methylbenzoyl)amino]butanoyl]oxyethyl benzoate CAS Name: benzoic acid 2-[(2S)-3-methyl-2-[[(4-methylphenyl)-oxomethyl]amino]-1-oxobutoxy]ethyl ester IUPAC Name: 2-[(2S)-3-methyl-2-[(4-methylbenzoyl)amino]butanoyl]oxyethyl benzoate Traditional Name: benzoic acid 2-[(2S)-3-methyl-2-(p-toluoylamino)butanoyl]oxyethyl ester Formula: C22H25NO5 MolecularWeight: 383.4376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC(C(C)C)C(=O)OCCOC(=O)C2=CC=CC=C2

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N[C@@H](C(C)C)C(=O)OCCOC(=O)C2=CC=CC=C2

InChI

InChI=1S/C22H25NO5/c1-15(2)19(23-20(24)17-11-9-16(3)10-12-17)22(26)28-14-13-27-21(25)18-7-5-4-6-8-18/h4-12,15,19H,13-14H2,1-3H3,(H,23,24)/t19-/m0/s1