4-[(2,4,6-trimethylphenyl)carbonylamino]butanoic acid

Systemtic Name: 4-[(2,4,6-trimethylphenyl)carbonylamino]butanoic acid Openeye Name: 4-[(2,4,6-trimethylbenzoyl)amino]butanoic acid CAS Name: 4-[[oxo-(2,4,6-trimethylphenyl)methyl]amino]butanoic acid IUPAC Name: 4-[(2,4,6-trimethylbenzoyl)amino]butanoic acid Traditional Name: 4-[(2,4,6-trimethylbenzoyl)amino]butyric acid Formula: C14H19NO3 MolecularWeight: 249.30556

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19NO3/c1-9-7-10(2)13(11(3)8-9)14(18)15-6-4-5-12(16)17/h7-8H,4-6H2,1-3H3,(H,15,18)(H,16,17)