3-methyl-2-[2-[(4-methylphenyl)carbonylamino]propanoylamino]butanoic acid

Systemtic Name: 3-methyl-2-[2-[(4-methylphenyl)carbonylamino]propanoylamino]butanoic acid Openeye Name: 3-methyl-2-[2-[(4-methylbenzoyl)amino]propanoylamino]butanoic acid CAS Name: 3-methyl-2-[[2-[[(4-methylphenyl)-oxomethyl]amino]-1-oxopropyl]amino]butanoic acid IUPAC Name: 3-methyl-2-[2-[(4-methylbenzoyl)amino]propanoylamino]butanoic acid Traditional Name: 3-methyl-2-[2-(p-toluoylamino)propanoylamino]butyric acid Formula: C16H22N2O4 MolecularWeight: 306.35688

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22N2O4/c1-9(2)13(16(21)22)18-14(19)11(4)17-15(20)12-7-5-10(3)6-8-12/h5-9,11,13H,1-4H3,(H,17,20)(H,18,19)(H,21,22)