(phenylmethyl) 2-[3-oxidanylidene-1-[3-(2-phenoxyethoxy)phenyl]carbonyl-piperazin-2-yl]ethanoate

Systemtic Name: (phenylmethyl) 2-[3-oxidanylidene-1-[3-(2-phenoxyethoxy)phenyl]carbonyl-piperazin-2-yl]ethanoate Openeye Name: benzyl 2-[3-oxo-1-[3-(2-phenoxyethoxy)benzoyl]piperazin-2-yl]acetate CAS Name: 2-[3-oxo-1-[oxo-[3-(2-phenoxyethoxy)phenyl]methyl]-2-piperazinyl]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[3-oxo-1-[3-(2-phenoxyethoxy)benzoyl]piperazin-2-yl]acetate Traditional Name: 2-[3-keto-1-[3-(2-phenoxyethoxy)benzoyl]piperazin-2-yl]acetic acid benzyl ester Formula: C28H28N2O6 MolecularWeight: 488.53172

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(C(=O)N1)CC(=O)OCC2=CC=CC=C2)C(=O)C3=CC(=CC=C3)OCCOC4=CC=CC=C4

Isomeric SMILES

C1CN(C(C(=O)N1)CC(=O)OCC2=CC=CC=C2)C(=O)C3=CC(=CC=C3)OCCOC4=CC=CC=C4

InChI

InChI=1S/C28H28N2O6/c31-26(36-20-21-8-3-1-4-9-21)19-25-27(32)29-14-15-30(25)28(33)22-10-7-13-24(18-22)35-17-16-34-23-11-5-2-6-12-23/h1-13,18,25H,14-17,19-20H2,(H,29,32)