3-azanylideneisoindol-1-amine; butanoate

Systemtic Name: 3-azanylideneisoindol-1-amine; butanoate Openeye Name: butanoate; 3-iminoisoindol-1-amine CAS Name: butanoate; 3-imino-1-isoindolamine IUPAC Name: butanoate; 3-iminoisoindol-1-amine Traditional Name: butyrate; (3-iminoisoindol-1-yl)amine Formula: C12H14N3O2- MolecularWeight: 232.25846

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)[O-].C1=CC=C2C(=C1)C(=NC2=N)N

Isomeric SMILES

CCCC(=O)[O-].C1=CC=C2C(=C1)C(=NC2=N)N

InChI

InChI=1S/C8H7N3.C4H8O2/c9-7-5-3-1-2-4-6(5)8(10)11-7;1-2-3-4(5)6/h1-4H,(H3,9,10,11);2-3H2,1H3,(H,5,6)/p-1