N-(3-azanyl-1H-isoindol-2-ium-2-yl)-2-(3,5-dimethylphenoxy)ethanamide

Systemtic Name: N-(3-azanyl-1H-isoindol-2-ium-2-yl)-2-(3,5-dimethylphenoxy)ethanamide Openeye Name: N-(3-amino-1H-isoindol-2-ium-2-yl)-2-(3,5-dimethylphenoxy)acetamide CAS Name: N-(3-amino-1H-isoindol-2-ium-2-yl)-2-(3,5-dimethylphenoxy)acetamide IUPAC Name: N-(3-amino-1H-isoindol-2-ium-2-yl)-2-(3,5-dimethylphenoxy)acetamide Traditional Name: N-(3-amino-1H-isoindol-2-ium-2-yl)-2-(3,5-dimethylphenoxy)acetamide Formula: C18H20N3O2+ MolecularWeight: 310.3703

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCC(=O)N[N+]2=C(C3=CC=CC=C3C2)N)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCC(=O)N[N+]2=C(C3=CC=CC=C3C2)N)C

InChI

InChI=1S/C18H19N3O2/c1-12-7-13(2)9-15(8-12)23-11-17(22)20-21-10-14-5-3-4-6-16(14)18(21)19/h3-9,19H,10-11H2,1-2H3,(H,20,22)/p+1