2-chloranyl-6-(2-methylpropyl)-1-oxidanidyl-5-phenylmethoxy-3-[[(E)-prop-1-enoxy]methyl]pyrazin-1-ium

Systemtic Name: 2-chloranyl-6-(2-methylpropyl)-1-oxidanidyl-5-phenylmethoxy-3-[[(E)-prop-1-enoxy]methyl]pyrazin-1-ium Openeye Name: 5-benzyloxy-2-chloro-6-isobutyl-1-oxido-3-[[(E)-prop-1-enoxy]methyl]pyrazin-1-ium CAS Name: 2-chloro-6-(2-methylpropyl)-1-oxido-5-phenylmethoxy-3-[[(E)-prop-1-enoxy]methyl]pyrazin-1-ium IUPAC Name: 2-chloro-6-(2-methylpropyl)-1-oxido-5-phenylmethoxy-3-[[(E)-prop-1-enoxy]methyl]pyrazin-1-ium Traditional Name: 5-benzoxy-2-chloro-6-isobutyl-1-oxido-3-[[(E)-prop-1-enoxy]methyl]pyrazin-1-ium Formula: C19H23ClN2O3 MolecularWeight: 362.85052

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Descriptors Computed from Structure

Canonical SMILES:

CC=COCC1=C([N+](=C(C(=N1)OCC2=CC=CC=C2)CC(C)C)[O-])Cl

Isomeric SMILES

C/C=C/OCC1=C([N+](=C(C(=N1)OCC2=CC=CC=C2)CC(C)C)[O-])Cl

InChI

InChI=1S/C19H23ClN2O3/c1-4-10-24-13-16-18(20)22(23)17(11-14(2)3)19(21-16)25-12-15-8-6-5-7-9-15/h4-10,14H,11-13H2,1-3H3/b10-4+