2-[4-(3,5-dimethylphenyl)carbonylpiperazin-1-yl]ethanoic acid

Systemtic Name: 2-[4-(3,5-dimethylphenyl)carbonylpiperazin-1-yl]ethanoic acid Openeye Name: 2-[4-(3,5-dimethylbenzoyl)piperazin-1-yl]acetic acid CAS Name: 2-[4-[(3,5-dimethylphenyl)-oxomethyl]-1-piperazinyl]acetic acid IUPAC Name: 2-[4-(3,5-dimethylbenzoyl)piperazin-1-yl]acetic acid Traditional Name: 2-[4-(3,5-dimethylbenzoyl)piperazino]acetic acid Formula: C15H20N2O3 MolecularWeight: 276.3309

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H20N2O3/c1-11-7-12(2)9-13(8-11)15(20)17-5-3-16(4-6-17)10-14(18)19/h7-9H,3-6,10H2,1-2H3,(H,18,19)