[2,5-bis(oxidanylidene)pyrrolidin-3-yl] (2S)-3-(4-hydroxyphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate

Systemtic Name: [2,5-bis(oxidanylidene)pyrrolidin-3-yl] (2S)-3-(4-hydroxyphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Openeye Name: (2,5-dioxopyrrolidin-3-yl) (2S)-2-(tert-butoxycarbonylamino)-3-(4-hydroxyphenyl)propanoate CAS Name: (2S)-3-(4-hydroxyphenyl)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid (2,5-dioxo-3-pyrrolidinyl) ester IUPAC Name: (2,5-dioxopyrrolidin-3-yl) (2S)-3-(4-hydroxyphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Traditional Name: (2S)-2-(tert-butoxycarbonylamino)-3-(4-hydroxyphenyl)propionic acid (2,5-diketopyrrolidin-3-yl) ester Formula: C18H22N2O7 MolecularWeight: 378.37648

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=C(C=C1)O)C(=O)OC2CC(=O)NC2=O

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)OC2CC(=O)NC2=O

InChI

InChI=1S/C18H22N2O7/c1-18(2,3)27-17(25)19-12(8-10-4-6-11(21)7-5-10)16(24)26-13-9-14(22)20-15(13)23/h4-7,12-13,21H,8-9H2,1-3H3,(H,19,25)(H,20,22,23)/t12-,13?/m0/s1