ditert-butyl 2-[4-[(2S)-3-methoxy-3-oxidanylidene-2-(phenylmethoxycarbonylamino)propyl]phenyl]propanedioate

Systemtic Name: ditert-butyl 2-[4-[(2S)-3-methoxy-3-oxidanylidene-2-(phenylmethoxycarbonylamino)propyl]phenyl]propanedioate Openeye Name: ditert-butyl 2-[4-[(2S)-2-(benzyloxycarbonylamino)-3-methoxy-3-oxo-propyl]phenyl]propanedioate CAS Name: 2-[4-[(2S)-3-methoxy-3-oxo-2-(phenylmethoxycarbonylamino)propyl]phenyl]propanedioic acid ditert-butyl ester IUPAC Name: ditert-butyl 2-[4-[(2S)-3-methoxy-3-oxo-2-(phenylmethoxycarbonylamino)propyl]phenyl]propanedioate Traditional Name: 2-[4-[(2S)-2-(benzyloxycarbonylamino)-3-keto-3-methoxy-propyl]phenyl]malonic acid ditert-butyl ester Formula: C29H37NO8 MolecularWeight: 527.60598

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(C1=CC=C(C=C1)CC(C(=O)OC)NC(=O)OCC2=CC=CC=C2)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)OC(=O)C(C1=CC=C(C=C1)C[C@@H](C(=O)OC)NC(=O)OCC2=CC=CC=C2)C(=O)OC(C)(C)C

InChI

InChI=1S/C29H37NO8/c1-28(2,3)37-25(32)23(26(33)38-29(4,5)6)21-15-13-19(14-16-21)17-22(24(31)35-7)30-27(34)36-18-20-11-9-8-10-12-20/h8-16,22-23H,17-18H2,1-7H3,(H,30,34)/t22-/m0/s1