methyl 4-[2-(4-chlorophenyl)-1-piperazin-1-yl-ethyl]benzoate

Systemtic Name: methyl 4-[2-(4-chlorophenyl)-1-piperazin-1-yl-ethyl]benzoate Openeye Name: methyl 4-[2-(4-chlorophenyl)-1-piperazin-1-yl-ethyl]benzoate CAS Name: 4-[2-(4-chlorophenyl)-1-(1-piperazinyl)ethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-(4-chlorophenyl)-1-piperazin-1-ylethyl]benzoate Traditional Name: 4-[2-(4-chlorophenyl)-1-piperazino-ethyl]benzoic acid methyl ester Formula: C20H23ClN2O2 MolecularWeight: 358.86182

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C(CC2=CC=C(C=C2)Cl)N3CCNCC3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C(CC2=CC=C(C=C2)Cl)N3CCNCC3

InChI

InChI=1S/C20H23ClN2O2/c1-25-20(24)17-6-4-16(5-7-17)19(23-12-10-22-11-13-23)14-15-2-8-18(21)9-3-15/h2-9,19,22H,10-14H2,1H3