(phenylmethyl) 2-[3-oxidanylidene-1-[4-(oxolan-2-ylmethoxy)phenyl]carbonyl-piperazin-2-yl]ethanoate

Systemtic Name: (phenylmethyl) 2-[3-oxidanylidene-1-[4-(oxolan-2-ylmethoxy)phenyl]carbonyl-piperazin-2-yl]ethanoate Openeye Name: benzyl 2-[3-oxo-1-[4-(tetrahydrofuran-2-ylmethoxy)benzoyl]piperazin-2-yl]acetate CAS Name: 2-[3-oxo-1-[oxo-[4-(2-oxolanylmethoxy)phenyl]methyl]-2-piperazinyl]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[3-oxo-1-[4-(oxolan-2-ylmethoxy)benzoyl]piperazin-2-yl]acetate Traditional Name: 2-[3-keto-1-[4-(tetrahydrofurfuryloxy)benzoyl]piperazin-2-yl]acetic acid benzyl ester Formula: C25H28N2O6 MolecularWeight: 452.49962

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)COC2=CC=C(C=C2)C(=O)N3CCNC(=O)C3CC(=O)OCC4=CC=CC=C4

Isomeric SMILES

C1CC(OC1)COC2=CC=C(C=C2)C(=O)N3CCNC(=O)C3CC(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C25H28N2O6/c28-23(33-16-18-5-2-1-3-6-18)15-22-24(29)26-12-13-27(22)25(30)19-8-10-20(11-9-19)32-17-21-7-4-14-31-21/h1-3,5-6,8-11,21-22H,4,7,12-17H2,(H,26,29)