2-[2-methyl-1-(4-propan-2-ylphenyl)propyl]-2-(propanoylamino)propanedioic acid

Systemtic Name: 2-[2-methyl-1-(4-propan-2-ylphenyl)propyl]-2-(propanoylamino)propanedioic acid Openeye Name: 2-[1-(4-isopropylphenyl)-2-methyl-propyl]-2-(propanoylamino)propanedioic acid CAS Name: 2-[2-methyl-1-(4-propan-2-ylphenyl)propyl]-2-(1-oxopropylamino)propanedioic acid IUPAC Name: 2-[2-methyl-1-(4-propan-2-ylphenyl)propyl]-2-(propanoylamino)propanedioic acid Traditional Name: 2-(2-methyl-1-p-cumenyl-propyl)-2-propionamido-malonic acid Formula: C19H27NO5 MolecularWeight: 349.42138

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H27NO5/c1-6-15(21)20-19(17(22)23,18(24)25)16(12(4)5)14-9-7-13(8-10-14)11(2)3/h7-12,16H,6H2,1-5H3,(H,20,21)(H,22,23)(H,24,25)