2-[4-(3-methyl-2-oxidanyl-phenyl)carbonylpiperazin-1-yl]ethanoic acid

Systemtic Name: 2-[4-(3-methyl-2-oxidanyl-phenyl)carbonylpiperazin-1-yl]ethanoic acid Openeye Name: 2-[4-(2-hydroxy-3-methyl-benzoyl)piperazin-1-yl]acetic acid CAS Name: 2-[4-[(2-hydroxy-3-methylphenyl)-oxomethyl]-1-piperazinyl]acetic acid IUPAC Name: 2-[4-(2-hydroxy-3-methylbenzoyl)piperazin-1-yl]acetic acid Traditional Name: 2-[4-(2-hydroxy-3-methyl-benzoyl)piperazino]acetic acid Formula: C14H18N2O4 MolecularWeight: 278.30372

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1O)C(=O)N2CCN(CC2)CC(=O)O

Isomeric SMILES

CC1=CC=CC(=C1O)C(=O)N2CCN(CC2)CC(=O)O

InChI

InChI=1S/C14H18N2O4/c1-10-3-2-4-11(13(10)19)14(20)16-7-5-15(6-8-16)9-12(17)18/h2-4,19H,5-9H2,1H3,(H,17,18)