(Z)-1-diazonio-4-[(2R,5S)-3,6-dimethoxy-2-propan-2-yl-5-propyl-2H-pyrazin-5-yl]but-1-en-2-olate

Systemtic Name: (Z)-1-diazonio-4-[(2R,5S)-3,6-dimethoxy-2-propan-2-yl-5-propyl-2H-pyrazin-5-yl]but-1-en-2-olate Openeye Name: (Z)-1-diazonio-4-[(2R,5S)-2-isopropyl-3,6-dimethoxy-5-propyl-2H-pyrazin-5-yl]but-1-en-2-olate CAS Name: (Z)-1-diazonio-4-[(2R,5S)-3,6-dimethoxy-2-propan-2-yl-5-propyl-2H-pyrazin-5-yl]-1-buten-2-olate IUPAC Name: (Z)-1-diazonio-4-[(2R,5S)-3,6-dimethoxy-2-propan-2-yl-5-propyl-2H-pyrazin-5-yl]but-1-en-2-olate Traditional Name: (Z)-1-diazonio-4-[(2R,5S)-2-isopropyl-3,6-dimethoxy-5-propyl-2H-pyrazin-5-yl]but-1-en-2-olate Formula: C16H26N4O3 MolecularWeight: 322.40264

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(C(=NC(C(=N1)OC)C(C)C)OC)CCC(=C[N+]#N)[O-]

Isomeric SMILES

CCC[C@@]1(C(=N[C@@H](C(=N1)OC)C(C)C)OC)CC/C(=C/[N+]#N)/[O-]

InChI

InChI=1S/C16H26N4O3/c1-6-8-16(9-7-12(21)10-18-17)15(23-5)19-13(11(2)3)14(20-16)22-4/h10-11,13H,6-9H2,1-5H3/b12-10-/t13-,16+/m1/s1