[2-oxidanylidene-2-[4-(2-phenoxyethyl)piperazin-1-yl]ethyl] 4-chloranyl-2-oxidanyl-benzoate

Systemtic Name: [2-oxidanylidene-2-[4-(2-phenoxyethyl)piperazin-1-yl]ethyl] 4-chloranyl-2-oxidanyl-benzoate Openeye Name: [2-oxo-2-[4-(2-phenoxyethyl)piperazin-1-yl]ethyl] 4-chloro-2-hydroxy-benzoate CAS Name: 4-chloro-2-hydroxybenzoic acid [2-oxo-2-[4-(2-phenoxyethyl)-1-piperazinyl]ethyl] ester IUPAC Name: [2-oxo-2-[4-(2-phenoxyethyl)piperazin-1-yl]ethyl] 4-chloro-2-hydroxybenzoate Traditional Name: 4-chloro-2-hydroxy-benzoic acid [2-keto-2-[4-(2-phenoxyethyl)piperazino]ethyl] ester Formula: C21H23ClN2O5 MolecularWeight: 418.87072

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCOC2=CC=CC=C2)C(=O)COC(=O)C3=C(C=C(C=C3)Cl)O

Isomeric SMILES

C1CN(CCN1CCOC2=CC=CC=C2)C(=O)COC(=O)C3=C(C=C(C=C3)Cl)O

InChI

InChI=1S/C21H23ClN2O5/c22-16-6-7-18(19(25)14-16)21(27)29-15-20(26)24-10-8-23(9-11-24)12-13-28-17-4-2-1-3-5-17/h1-7,14,25H,8-13,15H2