(phenylmethyl) N-[(2S)-1-(5-cyano-1,3-benzoxazol-2-yl)-3-methyl-1-oxidanyl-butan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[(2S)-1-(5-cyano-1,3-benzoxazol-2-yl)-3-methyl-1-oxidanyl-butan-2-yl]carbamate Openeye Name: benzyl N-[(1S)-1-[(5-cyano-1,3-benzoxazol-2-yl)-hydroxy-methyl]-2-methyl-propyl]carbamate CAS Name: N-[(2S)-1-(5-cyano-1,3-benzoxazol-2-yl)-1-hydroxy-3-methylbutan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(2S)-1-(5-cyano-1,3-benzoxazol-2-yl)-1-hydroxy-3-methylbutan-2-yl]carbamate Traditional Name: N-[(1S)-1-[(5-cyano-1,3-benzoxazol-2-yl)-hydroxy-methyl]-2-methyl-propyl]carbamic acid benzyl ester Formula: C21H21N3O4 MolecularWeight: 379.40914

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(C1=NC2=C(O1)C=CC(=C2)C#N)O)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)[C@@H](C(C1=NC2=C(O1)C=CC(=C2)C#N)O)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C21H21N3O4/c1-13(2)18(24-21(26)27-12-14-6-4-3-5-7-14)19(25)20-23-16-10-15(11-22)8-9-17(16)28-20/h3-10,13,18-19,25H,12H2,1-2H3,(H,24,26)/t18-,19?/m0/s1