4-bromanyl-3,5-dimethyl-1-oxidanidyl-1,2-dihydropyridin-1-ium

Systemtic Name: 4-bromanyl-3,5-dimethyl-1-oxidanidyl-1,2-dihydropyridin-1-ium Openeye Name: 4-bromo-3,5-dimethyl-1-oxido-1,2-dihydropyridin-1-ium CAS Name: 4-bromo-3,5-dimethyl-1-oxido-1,2-dihydropyridin-1-ium IUPAC Name: 4-bromo-3,5-dimethyl-1-oxido-1,2-dihydropyridin-1-ium Traditional Name: 4-bromo-3,5-dimethyl-1-oxido-1,2-dihydropyridin-1-ium Formula: C7H10BrNO MolecularWeight: 204.0644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C[NH+](C1)[O-])C)Br

Isomeric SMILES

CC1=C(C(=C[NH+](C1)[O-])C)Br

InChI

InChI=1S/C7H10BrNO/c1-5-3-9(10)4-6(2)7(5)8/h3,9H,4H2,1-2H3