4-[4-(2-methylpropanoyl)piperazin-1-yl]benzoate

Systemtic Name: 4-[4-(2-methylpropanoyl)piperazin-1-yl]benzoate Openeye Name: 4-[4-(2-methylpropanoyl)piperazin-1-yl]benzoate CAS Name: 4-[4-(2-methyl-1-oxopropyl)-1-piperazinyl]benzoate IUPAC Name: 4-[4-(2-methylpropanoyl)piperazin-1-yl]benzoate Traditional Name: 4-(4-isobutyrylpiperazino)benzoate Formula: C15H19N2O3- MolecularWeight: 275.32296

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H20N2O3/c1-11(2)14(18)17-9-7-16(8-10-17)13-5-3-12(4-6-13)15(19)20/h3-6,11H,7-10H2,1-2H3,(H,19,20)/p-1