3-[4-[1-(2,4-dimethylphenyl)ethyl]piperazin-1-yl]propanoic acid

Systemtic Name: 3-[4-[1-(2,4-dimethylphenyl)ethyl]piperazin-1-yl]propanoic acid Openeye Name: 3-[4-[1-(2,4-dimethylphenyl)ethyl]piperazin-1-yl]propanoic acid CAS Name: 3-[4-[1-(2,4-dimethylphenyl)ethyl]-1-piperazinyl]propanoic acid IUPAC Name: 3-[4-[1-(2,4-dimethylphenyl)ethyl]piperazin-1-yl]propanoic acid Traditional Name: 3-[4-[1-(2,4-dimethylphenyl)ethyl]piperazino]propionic acid Formula: C17H26N2O2 MolecularWeight: 290.40054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)N2CCN(CC2)CCC(=O)O)C

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)N2CCN(CC2)CCC(=O)O)C

InChI

InChI=1S/C17H26N2O2/c1-13-4-5-16(14(2)12-13)15(3)19-10-8-18(9-11-19)7-6-17(20)21/h4-5,12,15H,6-11H2,1-3H3,(H,20,21)