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

Systemtic Name: ethyl 4-[4-[4-(4-chlorophenyl)piperazin-1-yl]-2-oxidanyl-butoxy]benzoate Openeye Name: ethyl 4-[4-[4-(4-chlorophenyl)piperazin-1-yl]-2-hydroxy-butoxy]benzoate CAS Name: 4-[4-[4-(4-chlorophenyl)-1-piperazinyl]-2-hydroxybutoxy]benzoic acid ethyl ester IUPAC Name: ethyl 4-[4-[4-(4-chlorophenyl)piperazin-1-yl]-2-hydroxybutoxy]benzoate Traditional Name: 4-[4-[4-(4-chlorophenyl)piperazino]-2-hydroxy-butoxy]benzoic acid ethyl ester Formula: C23H29ClN2O4 MolecularWeight: 432.94036

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)OCC(CCN2CCN(CC2)C3=CC=C(C=C3)Cl)O

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)OCC(CCN2CCN(CC2)C3=CC=C(C=C3)Cl)O

InChI

InChI=1S/C23H29ClN2O4/c1-2-29-23(28)18-3-9-22(10-4-18)30-17-21(27)11-12-25-13-15-26(16-14-25)20-7-5-19(24)6-8-20/h3-10,21,27H,2,11-17H2,1H3