6-chloranyl-4-(3-methylbut-2-enyl)-4-oxidanidyl-2,3-dihydro-1H-quinoxalin-4-ium

Systemtic Name: 6-chloranyl-4-(3-methylbut-2-enyl)-4-oxidanidyl-2,3-dihydro-1H-quinoxalin-4-ium Openeye Name: 6-chloro-4-(3-methylbut-2-enyl)-4-oxido-2,3-dihydro-1H-quinoxalin-4-ium CAS Name: 6-chloro-4-(3-methylbut-2-enyl)-4-oxido-2,3-dihydro-1H-quinoxalin-4-ium IUPAC Name: 6-chloro-4-(3-methylbut-2-enyl)-4-oxido-2,3-dihydro-1H-quinoxalin-4-ium Traditional Name: 6-chloro-4-(3-methylbut-2-enyl)-4-oxido-2,3-dihydro-1H-quinoxalin-4-ium Formula: C13H17ClN2O MolecularWeight: 252.73988

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC[N+]1(CCNC2=C1C=C(C=C2)Cl)[O-])C

Isomeric SMILES

CC(=CC[N+]1(CCNC2=C1C=C(C=C2)Cl)[O-])C

InChI

InChI=1S/C13H17ClN2O/c1-10(2)5-7-16(17)8-6-15-12-4-3-11(14)9-13(12)16/h3-5,9,15H,6-8H2,1-2H3