tert-butyl (2S)-4-isocyanato-2-(phenylmethoxycarbonylamino)butanoate

Systemtic Name: tert-butyl (2S)-4-isocyanato-2-(phenylmethoxycarbonylamino)butanoate Openeye Name: tert-butyl (2S)-2-(benzyloxycarbonylamino)-4-isocyanato-butanoate CAS Name: (2S)-4-isocyanato-2-(phenylmethoxycarbonylamino)butanoic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-4-isocyanato-2-(phenylmethoxycarbonylamino)butanoate Traditional Name: (2S)-2-(benzyloxycarbonylamino)-4-isocyanato-butyric acid tert-butyl ester Formula: C17H22N2O5 MolecularWeight: 334.36698

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)(C)OC(=O)[C@H](CCN=C=O)NC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C17H22N2O5/c1-17(2,3)24-15(21)14(9-10-18-12-20)19-16(22)23-11-13-7-5-4-6-8-13/h4-8,14H,9-11H2,1-3H3,(H,19,22)/t14-/m0/s1