3-[(4-methoxyphenyl)methyl]-2-methyl-5,6,7,8-tetrahydrocinnolin-2-ium-4-olate

Systemtic Name: 3-[(4-methoxyphenyl)methyl]-2-methyl-5,6,7,8-tetrahydrocinnolin-2-ium-4-olate Openeye Name: 3-[(4-methoxyphenyl)methyl]-2-methyl-5,6,7,8-tetrahydrocinnolin-2-ium-4-olate CAS Name: 3-[(4-methoxyphenyl)methyl]-2-methyl-5,6,7,8-tetrahydrocinnolin-2-ium-4-olate IUPAC Name: 3-[(4-methoxyphenyl)methyl]-2-methyl-5,6,7,8-tetrahydrocinnolin-2-ium-4-olate Traditional Name: 2-methyl-3-p-anisyl-5,6,7,8-tetrahydrocinnolin-2-ium-4-olate Formula: C17H20N2O2 MolecularWeight: 284.3529

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(C(=C2CCCCC2=N1)[O-])CC3=CC=C(C=C3)OC

Isomeric SMILES

C[N+]1=C(C(=C2CCCCC2=N1)[O-])CC3=CC=C(C=C3)OC

InChI

InChI=1S/C17H20N2O2/c1-19-16(11-12-7-9-13(21-2)10-8-12)17(20)14-5-3-4-6-15(14)18-19/h7-10H,3-6,11H2,1-2H3