tert-butyl N-[(2E)-2-[(1S)-1-oxidanyl-1-pyrazin-2-yl-ethyl]penta-2,4-dienyl]carbamate

Systemtic Name: tert-butyl N-[(2E)-2-[(1S)-1-oxidanyl-1-pyrazin-2-yl-ethyl]penta-2,4-dienyl]carbamate Openeye Name: tert-butyl N-[(2E)-2-[(1S)-1-hydroxy-1-pyrazin-2-yl-ethyl]penta-2,4-dienyl]carbamate CAS Name: N-[(2E)-2-[(1S)-1-hydroxy-1-(2-pyrazinyl)ethyl]penta-2,4-dienyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2E)-2-[(1S)-1-hydroxy-1-pyrazin-2-ylethyl]penta-2,4-dienyl]carbamate Traditional Name: N-[(2E)-2-[(1S)-1-hydroxy-1-pyrazin-2-yl-ethyl]penta-2,4-dienyl]carbamic acid tert-butyl ester Formula: C16H23N3O3 MolecularWeight: 305.37212

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCC(=CC=C)C(C)(C1=NC=CN=C1)O

Isomeric SMILES

C[C@@](C1=NC=CN=C1)(/C(=C/C=C)/CNC(=O)OC(C)(C)C)O

InChI

InChI=1S/C16H23N3O3/c1-6-7-12(10-19-14(20)22-15(2,3)4)16(5,21)13-11-17-8-9-18-13/h6-9,11,21H,1,10H2,2-5H3,(H,19,20)/b12-7+/t16-/m0/s1