3-[(4-ethanoylpiperazin-1-yl)methyl]benzoate

Systemtic Name: 3-[(4-ethanoylpiperazin-1-yl)methyl]benzoate Openeye Name: 3-[(4-acetylpiperazin-1-yl)methyl]benzoate CAS Name: 3-[(4-acetyl-1-piperazinyl)methyl]benzoate IUPAC Name: 3-[(4-acetylpiperazin-1-yl)methyl]benzoate Traditional Name: 3-[(4-acetylpiperazino)methyl]benzoate Formula: C14H17N2O3- MolecularWeight: 261.29638

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)CC2=CC=CC(=C2)C(=O)[O-]

Isomeric SMILES

CC(=O)N1CCN(CC1)CC2=CC=CC(=C2)C(=O)[O-]

InChI

InChI=1S/C14H18N2O3/c1-11(17)16-7-5-15(6-8-16)10-12-3-2-4-13(9-12)14(18)19/h2-4,9H,5-8,10H2,1H3,(H,18,19)/p-1