3-methyl-2-[2-(2-phenylethanoylamino)propanoylamino]butanoic acid

Systemtic Name: 3-methyl-2-[2-(2-phenylethanoylamino)propanoylamino]butanoic acid Openeye Name: 3-methyl-2-[2-[(2-phenylacetyl)amino]propanoylamino]butanoic acid CAS Name: 3-methyl-2-[[1-oxo-2-[(1-oxo-2-phenylethyl)amino]propyl]amino]butanoic acid IUPAC Name: 3-methyl-2-[2-[(2-phenylacetyl)amino]propanoylamino]butanoic acid Traditional Name: 3-methyl-2-[2-[(2-phenylacetyl)amino]propanoylamino]butyric acid Formula: C16H22N2O4 MolecularWeight: 306.35688

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22N2O4/c1-10(2)14(16(21)22)18-15(20)11(3)17-13(19)9-12-7-5-4-6-8-12/h4-8,10-11,14H,9H2,1-3H3,(H,17,19)(H,18,20)(H,21,22)