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

Systemtic Name: (phenylmethyl) 2-[(2S)-1-[4-(2-methylpropoxy)phenyl]carbonyl-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: benzyl 2-[(2S)-1-(4-isobutoxybenzoyl)-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[(2S)-1-[[4-(2-methylpropoxy)phenyl]-oxomethyl]-3-oxo-2-piperazinyl]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[(2S)-1-[4-(2-methylpropoxy)benzoyl]-3-oxopiperazin-2-yl]acetate Traditional Name: 2-[(2S)-1-(4-isobutoxybenzoyl)-3-keto-piperazin-2-yl]acetic acid benzyl ester Formula: C24H28N2O5 MolecularWeight: 424.48952

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC=C(C=C1)C(=O)N2CCNC(=O)C2CC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)COC1=CC=C(C=C1)C(=O)N2CCNC(=O)[C@@H]2CC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C24H28N2O5/c1-17(2)15-30-20-10-8-19(9-11-20)24(29)26-13-12-25-23(28)21(26)14-22(27)31-16-18-6-4-3-5-7-18/h3-11,17,21H,12-16H2,1-2H3,(H,25,28)/t21-/m0/s1