ethyl (3R,4R,5S)-4-acetamido-3-oxidanyl-5-(phenylmethoxycarbonylamino)cyclohexene-1-carboxylate

Systemtic Name: ethyl (3R,4R,5S)-4-acetamido-3-oxidanyl-5-(phenylmethoxycarbonylamino)cyclohexene-1-carboxylate Openeye Name: ethyl (3R,4R,5S)-4-acetamido-5-(benzyloxycarbonylamino)-3-hydroxy-cyclohexene-1-carboxylate CAS Name: (3R,4R,5S)-4-acetamido-3-hydroxy-5-(phenylmethoxycarbonylamino)-1-cyclohexenecarboxylic acid ethyl ester IUPAC Name: ethyl (3R,4R,5S)-4-acetamido-3-hydroxy-5-(phenylmethoxycarbonylamino)cyclohexene-1-carboxylate Traditional Name: (3R,4R,5S)-4-acetamido-5-(benzyloxycarbonylamino)-3-hydroxy-cyclohexene-1-carboxylic acid ethyl ester Formula: C19H24N2O6 MolecularWeight: 376.40366

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(C(C(C1)NC(=O)OCC2=CC=CC=C2)NC(=O)C)O

Isomeric SMILES

CCOC(=O)C1=C[C@H]([C@@H]([C@H](C1)NC(=O)OCC2=CC=CC=C2)NC(=O)C)O

InChI

InChI=1S/C19H24N2O6/c1-3-26-18(24)14-9-15(17(16(23)10-14)20-12(2)22)21-19(25)27-11-13-7-5-4-6-8-13/h4-8,10,15-17,23H,3,9,11H2,1-2H3,(H,20,22)(H,21,25)/t15-,16+,17+/m0/s1