ethyl 3-[(1S,2R,4S)-1-azido-4-tert-butyl-2-(2-cyanoethyl)cyclohexyl]propanoate

Systemtic Name: ethyl 3-[(1S,2R,4S)-1-azido-4-tert-butyl-2-(2-cyanoethyl)cyclohexyl]propanoate Openeye Name: ethyl 3-[(1S,2R,4S)-1-azido-4-tert-butyl-2-(2-cyanoethyl)cyclohexyl]propanoate CAS Name: 3-[(1S,2R,4S)-1-azido-4-tert-butyl-2-(2-cyanoethyl)cyclohexyl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[(1S,2R,4S)-1-azido-4-tert-butyl-2-(2-cyanoethyl)cyclohexyl]propanoate Traditional Name: 3-[(1S,2R,4S)-1-azido-4-tert-butyl-2-(2-cyanoethyl)cyclohexyl]propionic acid ethyl ester Formula: C18H30N4O2 MolecularWeight: 334.4564

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC1(CCC(CC1CCC#N)C(C)(C)C)N=[N+]=[N-]

Isomeric SMILES

CCOC(=O)CC[C@]1(CC[C@@H](C[C@H]1CCC#N)C(C)(C)C)N=[N+]=[N-]

InChI

InChI=1S/C18H30N4O2/c1-5-24-16(23)9-11-18(21-22-20)10-8-14(17(2,3)4)13-15(18)7-6-12-19/h14-15H,5-11,13H2,1-4H3/t14-,15+,18-/m0/s1