3-[cyclohexylcarbonyl-(2,4-dimethylphenyl)amino]propanoic acid

Systemtic Name: 3-[cyclohexylcarbonyl-(2,4-dimethylphenyl)amino]propanoic acid Openeye Name: 3-[N-(cyclohexanecarbonyl)-2,4-dimethyl-anilino]propanoic acid CAS Name: 3-(N-[cyclohexyl(oxo)methyl]-2,4-dimethylanilino)propanoic acid IUPAC Name: 3-[N-(cyclohexanecarbonyl)-2,4-dimethylanilino]propanoic acid Traditional Name: 3-[N-(cyclohexanecarbonyl)-2,4-dimethyl-anilino]propionic acid Formula: C18H25NO3 MolecularWeight: 303.396

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N(CCC(=O)O)C(=O)C2CCCCC2)C

Isomeric SMILES

CC1=CC(=C(C=C1)N(CCC(=O)O)C(=O)C2CCCCC2)C

InChI

InChI=1S/C18H25NO3/c1-13-8-9-16(14(2)12-13)19(11-10-17(20)21)18(22)15-6-4-3-5-7-15/h8-9,12,15H,3-7,10-11H2,1-2H3,(H,20,21)