ethyl (3R,4R,5S)-4-azido-5-[(2-methylpropan-2-yl)oxycarbonylamino]-3-pentan-3-yloxy-cyclohexene-1-carboxylate

Systemtic Name: ethyl (3R,4R,5S)-4-azido-5-[(2-methylpropan-2-yl)oxycarbonylamino]-3-pentan-3-yloxy-cyclohexene-1-carboxylate Openeye Name: ethyl (3R,4R,5S)-4-azido-5-(tert-butoxycarbonylamino)-3-(1-ethylpropoxy)cyclohexene-1-carboxylate CAS Name: (3R,4R,5S)-4-azido-5-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-pentan-3-yloxy-1-cyclohexenecarboxylic acid ethyl ester IUPAC Name: ethyl (3R,4R,5S)-4-azido-5-[(2-methylpropan-2-yl)oxycarbonylamino]-3-pentan-3-yloxycyclohexene-1-carboxylate Traditional Name: (3R,4R,5S)-4-azido-5-(tert-butoxycarbonylamino)-3-(1-ethylpropoxy)cyclohexene-1-carboxylic acid ethyl ester Formula: C19H32N4O5 MolecularWeight: 396.48118

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)OC1C=C(CC(C1N=[N+]=[N-])NC(=O)OC(C)(C)C)C(=O)OCC

Isomeric SMILES

CCC(CC)O[C@@H]1C=C(C[C@@H]([C@H]1N=[N+]=[N-])NC(=O)OC(C)(C)C)C(=O)OCC

InChI

InChI=1S/C19H32N4O5/c1-7-13(8-2)27-15-11-12(17(24)26-9-3)10-14(16(15)22-23-20)21-18(25)28-19(4,5)6/h11,13-16H,7-10H2,1-6H3,(H,21,25)/t14-,15+,16+/m0/s1