2-phenoxyethyl 3-methyl-2-[(3-methylphenyl)carbonylamino]butanoate

Systemtic Name: 2-phenoxyethyl 3-methyl-2-[(3-methylphenyl)carbonylamino]butanoate Openeye Name: 2-phenoxyethyl 3-methyl-2-[(3-methylbenzoyl)amino]butanoate CAS Name: 3-methyl-2-[[(3-methylphenyl)-oxomethyl]amino]butanoic acid 2-phenoxyethyl ester IUPAC Name: 2-phenoxyethyl 3-methyl-2-[(3-methylbenzoyl)amino]butanoate Traditional Name: 3-methyl-2-(m-toluoylamino)butyric acid 2-phenoxyethyl ester Formula: C21H25NO4 MolecularWeight: 355.4275

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC(C(C)C)C(=O)OCCOC2=CC=CC=C2

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NC(C(C)C)C(=O)OCCOC2=CC=CC=C2

InChI

InChI=1S/C21H25NO4/c1-15(2)19(22-20(23)17-9-7-8-16(3)14-17)21(24)26-13-12-25-18-10-5-4-6-11-18/h4-11,14-15,19H,12-13H2,1-3H3,(H,22,23)