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

Systemtic Name: methyl 4-[(4-chlorophenyl)-piperazin-1-yl-methyl]benzoate Openeye Name: methyl 4-[(4-chlorophenyl)-piperazin-1-yl-methyl]benzoate CAS Name: 4-[(4-chlorophenyl)-(1-piperazinyl)methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(4-chlorophenyl)-piperazin-1-ylmethyl]benzoate Traditional Name: 4-[(4-chlorophenyl)-piperazino-methyl]benzoic acid methyl ester Formula: C19H21ClN2O2 MolecularWeight: 344.83524

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21ClN2O2/c1-24-19(23)16-4-2-14(3-5-16)18(22-12-10-21-11-13-22)15-6-8-17(20)9-7-15/h2-9,18,21H,10-13H2,1H3