diethyl 2-[4-[(2S)-3-methoxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanylidene-propyl]phenyl]propanedioate

Systemtic Name: diethyl 2-[4-[(2S)-3-methoxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanylidene-propyl]phenyl]propanedioate Openeye Name: diethyl 2-[4-[(2S)-2-(tert-butoxycarbonylamino)-3-methoxy-3-oxo-propyl]phenyl]propanedioate CAS Name: 2-[4-[(2S)-3-methoxy-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-oxopropyl]phenyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[4-[(2S)-3-methoxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]phenyl]propanedioate Traditional Name: 2-[4-[(2S)-2-(tert-butoxycarbonylamino)-3-keto-3-methoxy-propyl]phenyl]malonic acid diethyl ester Formula: C22H31NO8 MolecularWeight: 437.48344

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=CC=C(C=C1)CC(C(=O)OC)NC(=O)OC(C)(C)C)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(C1=CC=C(C=C1)C[C@@H](C(=O)OC)NC(=O)OC(C)(C)C)C(=O)OCC

InChI

InChI=1S/C22H31NO8/c1-7-29-19(25)17(20(26)30-8-2)15-11-9-14(10-12-15)13-16(18(24)28-6)23-21(27)31-22(3,4)5/h9-12,16-17H,7-8,13H2,1-6H3,(H,23,27)/t16-/m0/s1