O1,O1-ditert-butyl O3-methyl 3-(phenylmethoxycarbonylamino)propane-1,1,3-tricarboxylate

Systemtic Name: O1,O1-ditert-butyl O3-methyl 3-(phenylmethoxycarbonylamino)propane-1,1,3-tricarboxylate Openeye Name: O1,O1-ditert-butyl O3-methyl 3-(benzyloxycarbonylamino)propane-1,1,3-tricarboxylate CAS Name: 3-(phenylmethoxycarbonylamino)propane-1,1,3-tricarboxylic acid O1,O1-ditert-butyl ester O3-methyl ester IUPAC Name: 1-O,1-O-ditert-butyl 3-O-methyl 3-(phenylmethoxycarbonylamino)propane-1,1,3-tricarboxylate Traditional Name: 3-(benzyloxycarbonylamino)propane-1,1,3-tricarboxylic acid O1,O1-ditert-butyl ester O3-methyl ester Formula: C23H33NO8 MolecularWeight: 451.51002

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(CC(C(=O)OC)NC(=O)OCC1=CC=CC=C1)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)OC(=O)C(CC(C(=O)OC)NC(=O)OCC1=CC=CC=C1)C(=O)OC(C)(C)C

InChI

InChI=1S/C23H33NO8/c1-22(2,3)31-18(25)16(19(26)32-23(4,5)6)13-17(20(27)29-7)24-21(28)30-14-15-11-9-8-10-12-15/h8-12,16-17H,13-14H2,1-7H3,(H,24,28)