1-(3-azanyl-1H-isoindol-2-ium-2-yl)propan-2-one

Systemtic Name: 1-(3-azanyl-1H-isoindol-2-ium-2-yl)propan-2-one Openeye Name: 1-(3-amino-1H-isoindol-2-ium-2-yl)propan-2-one CAS Name: 1-(3-amino-1H-isoindol-2-ium-2-yl)-2-propanone IUPAC Name: 1-(3-amino-1H-isoindol-2-ium-2-yl)propan-2-one Traditional Name: 1-(3-amino-1H-isoindol-2-ium-2-yl)acetone Formula: C11H13N2O+ MolecularWeight: 189.23372

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C[N+]1=C(C2=CC=CC=C2C1)N

Isomeric SMILES

CC(=O)C[N+]1=C(C2=CC=CC=C2C1)N

InChI

InChI=1S/C11H12N2O/c1-8(14)6-13-7-9-4-2-3-5-10(9)11(13)12/h2-5,12H,6-7H2,1H3/p+1