(phenylmethyl) 4-[(2S)-1-(2-methoxy-2-oxidanylidene-ethanoyl)pyrrolidin-2-yl]-4-oxidanylidene-2-(phenylmethyl)butanoate

Systemtic Name: (phenylmethyl) 4-[(2S)-1-(2-methoxy-2-oxidanylidene-ethanoyl)pyrrolidin-2-yl]-4-oxidanylidene-2-(phenylmethyl)butanoate Openeye Name: benzyl 2-benzyl-4-[(2S)-1-(2-methoxy-2-oxo-acetyl)pyrrolidin-2-yl]-4-oxo-butanoate CAS Name: 4-[(2S)-1-(2-methoxy-1,2-dioxoethyl)-2-pyrrolidinyl]-4-oxo-2-(phenylmethyl)butanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-benzyl-4-[(2S)-1-(2-methoxy-2-oxoacetyl)pyrrolidin-2-yl]-4-oxobutanoate Traditional Name: 2-benzyl-4-keto-4-[(2S)-1-methoxalylpyrrolidin-2-yl]butyric acid benzyl ester Formula: C25H27NO6 MolecularWeight: 437.48498

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=O)N1CCCC1C(=O)CC(CC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

COC(=O)C(=O)N1CCC[C@H]1C(=O)CC(CC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C25H27NO6/c1-31-25(30)23(28)26-14-8-13-21(26)22(27)16-20(15-18-9-4-2-5-10-18)24(29)32-17-19-11-6-3-7-12-19/h2-7,9-12,20-21H,8,13-17H2,1H3/t20?,21-/m0/s1