(1E,5E)-2-methoxy-11-methyl-3,4-dihydropyrido[1,2-a][1,3]diazocin-7-ium-5-olate

Systemtic Name: (1E,5E)-2-methoxy-11-methyl-3,4-dihydropyrido[1,2-a][1,3]diazocin-7-ium-5-olate Openeye Name: (1E,5E)-2-methoxy-11-methyl-3,4-dihydropyrido[1,2-a][1,3]diazocin-7-ium-5-olate CAS Name: (1E,5E)-2-methoxy-11-methyl-3,4-dihydropyrido[1,2-a][1,3]diazocin-7-ium-5-olate IUPAC Name: (1E,5E)-2-methoxy-11-methyl-3,4-dihydropyrido[1,2-a][1,3]diazocin-7-ium-5-olate Traditional Name: (1E,5E)-2-methoxy-11-methyl-3,4-dihydropyrido[1,2-a][1,3]diazocin-7-ium-5-olate Formula: C12H14N2O2 MolecularWeight: 218.25176

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2N=C(CCC(=C[N+]2=CC=C1)[O-])OC

Isomeric SMILES

CC1=C2/N=C(\CC/C(=C\[N+]2=CC=C1)/[O-])/OC

InChI

InChI=1S/C12H14N2O2/c1-9-4-3-7-14-8-10(15)5-6-11(16-2)13-12(9)14/h3-4,7-8H,5-6H2,1-2H3/b10-8+