(phenylmethyl) 2-[(2S)-3-oxidanylidene-1-(4-propan-2-yloxyphenyl)carbonyl-piperazin-2-yl]ethanoate

Systemtic Name: (phenylmethyl) 2-[(2S)-3-oxidanylidene-1-(4-propan-2-yloxyphenyl)carbonyl-piperazin-2-yl]ethanoate Openeye Name: benzyl 2-[(2S)-1-(4-isopropoxybenzoyl)-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[(2S)-3-oxo-1-[oxo-(4-propan-2-yloxyphenyl)methyl]-2-piperazinyl]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[(2S)-3-oxo-1-(4-propan-2-yloxybenzoyl)piperazin-2-yl]acetate Traditional Name: 2-[(2S)-1-(4-isopropoxybenzoyl)-3-keto-piperazin-2-yl]acetic acid benzyl ester Formula: C23H26N2O5 MolecularWeight: 410.46294

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)C(=O)N2CCNC(=O)C2CC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)C(=O)N2CCNC(=O)[C@@H]2CC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C23H26N2O5/c1-16(2)30-19-10-8-18(9-11-19)23(28)25-13-12-24-22(27)20(25)14-21(26)29-15-17-6-4-3-5-7-17/h3-11,16,20H,12-15H2,1-2H3,(H,24,27)/t20-/m0/s1