N-(3-azanyl-1H-isoindol-2-ium-2-yl)-2-(4-tert-butylphenoxy)ethanamide

Systemtic Name: N-(3-azanyl-1H-isoindol-2-ium-2-yl)-2-(4-tert-butylphenoxy)ethanamide Openeye Name: N-(3-amino-1H-isoindol-2-ium-2-yl)-2-(4-tert-butylphenoxy)acetamide CAS Name: N-(3-amino-1H-isoindol-2-ium-2-yl)-2-(4-tert-butylphenoxy)acetamide IUPAC Name: N-(3-amino-1H-isoindol-2-ium-2-yl)-2-(4-tert-butylphenoxy)acetamide Traditional Name: N-(3-amino-1H-isoindol-2-ium-2-yl)-2-(4-tert-butylphenoxy)acetamide Formula: C20H24N3O2+ MolecularWeight: 338.42346

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23N3O2/c1-20(2,3)15-8-10-16(11-9-15)25-13-18(24)22-23-12-14-6-4-5-7-17(14)19(23)21/h4-11,21H,12-13H2,1-3H3,(H,22,24)/p+1