methyl 5-[2-[4-(4-chlorophenyl)piperazin-1-yl]-1-oxidanyl-ethyl]-2-oxidanyl-benzoate

Systemtic Name: methyl 5-[2-[4-(4-chlorophenyl)piperazin-1-yl]-1-oxidanyl-ethyl]-2-oxidanyl-benzoate Openeye Name: methyl 5-[2-[4-(4-chlorophenyl)piperazin-1-yl]-1-hydroxy-ethyl]-2-hydroxy-benzoate CAS Name: 5-[2-[4-(4-chlorophenyl)-1-piperazinyl]-1-hydroxyethyl]-2-hydroxybenzoic acid methyl ester IUPAC Name: methyl 5-[2-[4-(4-chlorophenyl)piperazin-1-yl]-1-hydroxyethyl]-2-hydroxybenzoate Traditional Name: 5-[2-[4-(4-chlorophenyl)piperazino]-1-hydroxy-ethyl]-2-hydroxy-benzoic acid methyl ester Formula: C20H23ClN2O4 MolecularWeight: 390.86062

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC(=C1)C(CN2CCN(CC2)C3=CC=C(C=C3)Cl)O)O

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1)C(CN2CCN(CC2)C3=CC=C(C=C3)Cl)O)O

InChI

InChI=1S/C20H23ClN2O4/c1-27-20(26)17-12-14(2-7-18(17)24)19(25)13-22-8-10-23(11-9-22)16-5-3-15(21)4-6-16/h2-7,12,19,24-25H,8-11,13H2,1H3