methyl 4-[2,5-bis(oxidanylidene)pyrrolidin-3-yl]-2-(phenylmethoxycarbonylamino)butanoate

Systemtic Name: methyl 4-[2,5-bis(oxidanylidene)pyrrolidin-3-yl]-2-(phenylmethoxycarbonylamino)butanoate Openeye Name: methyl 2-(benzyloxycarbonylamino)-4-(2,5-dioxopyrrolidin-3-yl)butanoate CAS Name: 4-(2,5-dioxo-3-pyrrolidinyl)-2-(phenylmethoxycarbonylamino)butanoic acid methyl ester IUPAC Name: methyl 4-(2,5-dioxopyrrolidin-3-yl)-2-(phenylmethoxycarbonylamino)butanoate Traditional Name: 2-(benzyloxycarbonylamino)-4-(2,5-diketopyrrolidin-3-yl)butyric acid methyl ester Formula: C17H20N2O6 MolecularWeight: 348.3505

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCC1CC(=O)NC1=O)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

COC(=O)C(CCC1CC(=O)NC1=O)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C17H20N2O6/c1-24-16(22)13(8-7-12-9-14(20)19-15(12)21)18-17(23)25-10-11-5-3-2-4-6-11/h2-6,12-13H,7-10H2,1H3,(H,18,23)(H,19,20,21)