tert-butyl N-[(2S,3R)-1-imidazol-1-yl-1-oxidanylidene-3-phenylmethoxy-butan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2S,3R)-1-imidazol-1-yl-1-oxidanylidene-3-phenylmethoxy-butan-2-yl]carbamate Openeye Name: tert-butyl N-[(1S,2R)-2-benzyloxy-1-(imidazole-1-carbonyl)propyl]carbamate CAS Name: N-[(2S,3R)-1-(1-imidazolyl)-1-oxo-3-phenylmethoxybutan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S,3R)-1-imidazol-1-yl-1-oxo-3-phenylmethoxybutan-2-yl]carbamate Traditional Name: N-[(1S,2R)-2-benzoxy-1-(imidazole-1-carbonyl)propyl]carbamic acid tert-butyl ester Formula: C19H25N3O4 MolecularWeight: 359.4195

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)N1C=CN=C1)NC(=O)OC(C)(C)C)OCC2=CC=CC=C2

Isomeric SMILES

C[C@H]([C@@H](C(=O)N1C=CN=C1)NC(=O)OC(C)(C)C)OCC2=CC=CC=C2

InChI

InChI=1S/C19H25N3O4/c1-14(25-12-15-8-6-5-7-9-15)16(17(23)22-11-10-20-13-22)21-18(24)26-19(2,3)4/h5-11,13-14,16H,12H2,1-4H3,(H,21,24)/t14-,16+/m1/s1