4-[4-[2-(2-methylphenoxy)ethanoyl]piperazin-1-yl]benzoate

Systemtic Name: 4-[4-[2-(2-methylphenoxy)ethanoyl]piperazin-1-yl]benzoate Openeye Name: 4-[4-[2-(2-methylphenoxy)acetyl]piperazin-1-yl]benzoate CAS Name: 4-[4-[2-(2-methylphenoxy)-1-oxoethyl]-1-piperazinyl]benzoate IUPAC Name: 4-[4-[2-(2-methylphenoxy)acetyl]piperazin-1-yl]benzoate Traditional Name: 4-[4-[2-(2-methylphenoxy)acetyl]piperazino]benzoate Formula: C20H21N2O4- MolecularWeight: 353.39174

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCC(=O)N2CCN(CC2)C3=CC=C(C=C3)C(=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1OCC(=O)N2CCN(CC2)C3=CC=C(C=C3)C(=O)[O-]

InChI

InChI=1S/C20H22N2O4/c1-15-4-2-3-5-18(15)26-14-19(23)22-12-10-21(11-13-22)17-8-6-16(7-9-17)20(24)25/h2-9H,10-14H2,1H3,(H,24,25)/p-1