[2-oxidanylidene-2-[4-(2-phenoxyethyl)piperazin-1-yl]ethyl] 2-azanyl-5-chloranyl-benzoate

Systemtic Name: [2-oxidanylidene-2-[4-(2-phenoxyethyl)piperazin-1-yl]ethyl] 2-azanyl-5-chloranyl-benzoate Openeye Name: [2-oxo-2-[4-(2-phenoxyethyl)piperazin-1-yl]ethyl] 2-amino-5-chloro-benzoate CAS Name: 2-amino-5-chlorobenzoic acid [2-oxo-2-[4-(2-phenoxyethyl)-1-piperazinyl]ethyl] ester IUPAC Name: [2-oxo-2-[4-(2-phenoxyethyl)piperazin-1-yl]ethyl] 2-amino-5-chlorobenzoate Traditional Name: 2-amino-5-chloro-benzoic acid [2-keto-2-[4-(2-phenoxyethyl)piperazino]ethyl] ester Formula: C21H24ClN3O4 MolecularWeight: 417.88596

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24ClN3O4/c22-16-6-7-19(23)18(14-16)21(27)29-15-20(26)25-10-8-24(9-11-25)12-13-28-17-4-2-1-3-5-17/h1-7,14H,8-13,15,23H2