2-(3,4-dimethoxyphenyl)-3H-isoindol-2-ium-1-amine

Systemtic Name: 2-(3,4-dimethoxyphenyl)-3H-isoindol-2-ium-1-amine Openeye Name: 2-(3,4-dimethoxyphenyl)-3H-isoindol-2-ium-1-amine CAS Name: 2-(3,4-dimethoxyphenyl)-3H-isoindol-2-ium-1-amine IUPAC Name: 2-(3,4-dimethoxyphenyl)-3H-isoindol-2-ium-1-amine Traditional Name: [2-(3,4-dimethoxyphenyl)-3H-isoindol-2-ium-1-yl]amine Formula: C16H17N2O2+ MolecularWeight: 269.31838

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+]2=C(C3=CC=CC=C3C2)N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)[N+]2=C(C3=CC=CC=C3C2)N)OC

InChI

InChI=1S/C16H16N2O2/c1-19-14-8-7-12(9-15(14)20-2)18-10-11-5-3-4-6-13(11)16(18)17/h3-9,17H,10H2,1-2H3/p+1