3-azanyl-4-chloranyl-isoindol-1-one

Systemtic Name: 3-azanyl-4-chloranyl-isoindol-1-one Openeye Name: 3-amino-4-chloro-isoindol-1-one CAS Name: 3-amino-4-chloro-1-isoindolone IUPAC Name: 3-amino-4-chloroisoindol-1-one Traditional Name: 3-amino-4-chloro-isoindol-1-one Formula: C8H5ClN2O MolecularWeight: 180.5911

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)Cl)C(=NC2=O)N

Isomeric SMILES

C1=CC2=C(C(=C1)Cl)C(=NC2=O)N

InChI

InChI=1S/C8H5ClN2O/c9-5-3-1-2-4-6(5)7(10)11-8(4)12/h1-3H,(H2,10,11,12)