methyl 2-(2-chlorophenyl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethanoate

Systemtic Name: methyl 2-(2-chlorophenyl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethanoate Openeye Name: methyl 2-(2-chlorophenyl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)acetate CAS Name: 2-(2-chlorophenyl)-2-[4-(2-pyrimidinyl)-1-piperazinyl]acetic acid methyl ester IUPAC Name: methyl 2-(2-chlorophenyl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)acetate Traditional Name: 2-(2-chlorophenyl)-2-[4-(2-pyrimidyl)piperazino]acetic acid methyl ester Formula: C17H19ClN4O2 MolecularWeight: 346.81136

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1=CC=CC=C1Cl)N2CCN(CC2)C3=NC=CC=N3

Isomeric SMILES

COC(=O)C(C1=CC=CC=C1Cl)N2CCN(CC2)C3=NC=CC=N3

InChI

InChI=1S/C17H19ClN4O2/c1-24-16(23)15(13-5-2-3-6-14(13)18)21-9-11-22(12-10-21)17-19-7-4-8-20-17/h2-8,15H,9-12H2,1H3