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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC=COC1=NC(=C([N+](=C1Cl)[O-])CC(C)C)COCC2=CC=CC=C2

Isomeric SMILES

C/C=C/OC1=NC(=C([N+](=C1Cl)[O-])CC(C)C)COCC2=CC=CC=C2

InChI

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