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

Systemtic Name: tert-butyl (2S)-4-(aminocarbonylamino)-2-(phenylmethoxycarbonylamino)butanoate Openeye Name: tert-butyl (2S)-2-(benzyloxycarbonylamino)-4-ureido-butanoate CAS Name: (2S)-4-(carbamoylamino)-2-(phenylmethoxycarbonylamino)butanoic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-4-(carbamoylamino)-2-(phenylmethoxycarbonylamino)butanoate Traditional Name: (2S)-2-(benzyloxycarbonylamino)-4-ureido-butyric acid tert-butyl ester Formula: C17H25N3O5 MolecularWeight: 351.3975

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H25N3O5/c1-17(2,3)25-14(21)13(9-10-19-15(18)22)20-16(23)24-11-12-7-5-4-6-8-12/h4-8,13H,9-11H2,1-3H3,(H,20,23)(H3,18,19,22)/t13-/m0/s1